Mercurial > repos > recetox > mfassignr_mfassign
comparison test-data/recal/recalibrants.tabular @ 0:5aa9380f397b draft
planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/mfassignr commit 87bb82e07c57753a71d9ce4efc757c4367200d15
| author | recetox |
|---|---|
| date | Thu, 15 Aug 2024 12:00:54 +0000 |
| parents | |
| children |
comparison
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| -1:000000000000 | 0:5aa9380f397b |
|---|---|
| 1 "abundance" "exp_mass" "theor_mass" "recal_err" "orig_err" | |
| 2 115.054231533359 "C9H6" 115.05422664356 0.728984639913248 0.0424999510570841 | |
| 3 117.069572629504 "C9H8" 117.06987670736 3.36888732269624 2.59740476844203 | |
| 4 117.069742846604 "C9H8" 117.06987670736 1.91490980541242 1.14342612941356 | |
| 5 117.070083035453 "C9H8" 117.06987670736 0.990949465277487 1.76243538306623 | |
| 6 119.049041072813 "C8H6O" 119.04914126586 1.61309474232647 0.841610833463941 | |
| 7 119.085478343665 "C9H10" 119.08552677116 1.17814571129887 0.406661466893596 | |
| 8 121.028406955477 "C7H4O2" 121.02840582436 0.762138685010039 0.00934588037431393 | |
| 9 121.028559025627 "C7H4O2" 121.02840582436 0.494343474380556 1.2658290090465 | |
| 10 121.028559025773 "C7H4O2" 121.02840582436 0.49434468072811 1.26583021539405 | |
| 11 121.064480614559 "C8H8O" 121.06479132966 3.33800169223651 2.56651911411759 | |
| 12 121.064772496781 "C8H8O" 121.06479132966 0.927044769004804 0.155560330847126 | |
| 13 121.064839051124 "C8H8O" 121.06479132966 0.377303668240503 0.394181194019159 | |
| 14 121.101133005817 "C9H12" 121.10117683496 1.13340597227909 0.361921693424699 | |
| 15 123.044127955122 "C7H6O2" 123.04405588816 0.185784534949134 0.585700475091766 | |
| 16 123.044311353059 "C7H6O2" 123.04405588816 1.30472058698086 2.07620674688039 | |
| 17 123.044312115776 "C7H6O2" 123.04405588816 1.31091931316403 2.08240547779882 | |
| 18 123.08040073282 "C8H10O" 123.08044139346 1.10184255966829 0.330358256357986 | |
| 19 123.080583711079 "C8H10O" 123.08044139346 0.384812149861727 1.15629760003515 | |
| 20 123.080584214953 "C8H10O" 123.08044139346 0.38890600589622 1.16039145930252 | |
| 21 123.116871592357 "C9H14" 123.11682689876 0.408467059606618 0.363017778564131 | |
| 22 125.059595214589 "C7H8O2" 125.05970595196 1.65695989747293 0.885476022511153 | |
| 23 125.059596220818 "C7H8O2" 125.05970595196 1.64891391487979 0.87743003366822 | |
| 24 125.059782634153 "C7H8O2" 125.05970595196 0.158320363837114 0.613164667335975 | |
| 25 125.059782634211 "C7H8O2" 125.05970595196 0.158319899988998 0.61316513118409 | |
| 26 125.096198635223 "C8H12O" 125.09609145726 0.0852798625176126 0.856765081577565 | |
| 27 127.075190047638 "C7H10O2" 127.07535601576 2.07754419985918 1.30606064932025 | |
| 28 127.075382018668 "C7H10O2" 127.07535601576 0.56685882462213 0.204625891410509 | |
| 29 127.075574244373 "C7H10O2" 127.07535601576 0.945830675085174 1.71731655806531 | |
| 30 129.09108390255 "C7H12O2" 129.09100607956 0.168631328339575 0.602853694901326 | |
| 31 131.049175570564 "C9H6O" 131.04914126586 0.509714986706681 0.261769773312007 | |
| 32 131.049376883118 "C9H6O" 131.04914126586 1.02644463042826 1.79793057568662 | |
| 33 133.064927298151 "C9H8O" 133.06479132966 0.250336351211823 1.02182169769629 | |
| 34 135.044116878167 "C8H6O2" 135.04405588816 0.319854461932368 0.451630444592379 | |
| 35 135.044203360548 "C8H6O2" 135.04405588816 0.320546285208052 1.09203168589875 | |
| 36 135.044327465856 "C8H6O2" 135.04405588816 1.23954424801883 2.01103035754722 | |
| 37 135.080555334188 "C9H10O" 135.08044139346 0.0720175722814306 0.84350278118667 | |
| 38 137.059611 "C8H8O2" 137.05970595196 1.4642621042632 0.692778080641059 | |
| 39 137.059829579825 "C8H8O2" 137.05970595196 0.130514820569244 0.90200007450193 | |
| 40 137.096008386905 "C9H12O" 137.09609145726 1.37741205051386 0.60592795987589 | |
| 41 137.096008386934 "C9H12O" 137.09609145726 1.37741183905529 0.605927748417319 | |
| 42 137.0962229778 "C9H12O" 137.09609145726 0.187845771027137 0.959331069259402 | |
| 43 137.096223261009 "C9H12O" 137.09609145726 0.189911539247708 0.961396839138472 | |
| 44 137.132634373636 "C10H16" 137.13247696256 0.376390533578859 1.14787597722877 | |
| 45 139.075436413401 "C8H10O2" 139.07535601576 0.193398107200187 0.578086896938466 | |
| 46 139.075437251552 "C8H10O2" 139.07535601576 0.187371515920322 0.584113492918656 | |
| 47 139.075438077895 "C8H10O2" 139.07535601576 0.181429827829847 0.590055185505093 | |
| 48 139.075657338995 "C8H10O2" 139.07535601576 1.39513223978011 2.16661846947731 | |
| 49 139.111759045347 "C9H14O" 139.11174152106 0.645511917232047 0.125972738153041 | |
| 50 139.111759327331 "C9H14O" 139.11174152106 0.643484886310294 0.127999770504954 | |
| 51 141.069714774956 "C11H8" 141.06987670736 1.91937156888366 1.14788789635079 | |
| 52 141.09107540126 "C8H12O2" 141.09100607956 0.280158792853567 0.491326144286016 | |
| 53 141.127515919829 "C9H16O" 141.12739158486 0.109527070302526 0.881012308136338 | |
| 54 143.106736833058 "C8H14O2" 143.10665614336 0.207641911591673 0.563843081585299 | |
| 55 143.106747317844 "C8H14O2" 143.10665614336 0.134376431049012 0.637108618531804 | |
| 56 122.031729582056 "C7H4O2" 122.03176082436 1.02750216922641 0.256017808634792 | |
| 57 122.031910477811 "C7H4O2" 122.03176082436 0.454862865967863 1.22634837023555 | |
| 58 122.031910477811 "C7H4O2" 122.03176082436 0.454862865967863 1.22634837023555 | |
| 59 122.068097517923 "C8H8O" 122.06814632966 1.17135709498149 0.399872845375484 | |
| 60 122.068097517923 "C8H8O" 122.06814632966 1.17135709498149 0.399872845375484 | |
| 61 122.068097517923 "C8H8O" 122.06814632966 1.17135709498149 0.399872845375484 | |
| 62 122.104664227996 "C9H12" 122.10453183496 0.312774411413287 1.08425980598551 | |
| 63 132.0524023 "C9H6O" 132.05249626586 1.4830635902409 0.711579581090286 | |
| 64 132.0524023 "C9H6O" 132.05249626586 1.4830635902409 0.711579581090286 | |
| 65 138.062769711912 "C8H8O2" 138.06306095196 2.88095411004656 2.10947117927005 | |
| 66 138.063314108629 "C8H8O2" 138.06306095196 1.06214474082708 1.83363071360192 | |
| 67 145.0647978 "C10H8O" 145.06479132966 0.23160805451764 0.0446031041565306 | |
| 68 145.064798137177 "C10H8O" 145.06479132966 0.23393237493311 0.046927424180152 | |
| 69 145.064798431228 "C10H8O" 145.06479132966 0.235959407543264 0.0489544563984574 | |
| 70 145.101146559638 "C11H12" 145.10117683496 0.0216448313083043 0.208649734276678 | |
| 71 145.101147975532 "C11H12" 145.10117683496 0.0118868522403385 0.198891756971589 | |
| 72 145.101380561463 "C11H12" 145.10117683496 1.59103587787737 1.40403067326132 | |
| 73 147.044179044524 "C9H6O2" 147.04405588816 1.02455248016907 0.837547381658829 | |
| 74 147.080316009467 "C10H10O" 147.08044139346 0.665481053246733 0.852485835783122 | |
| 75 147.080316611482 "C10H10O" 147.08044139346 0.661387952119774 0.84839273542912 | |
| 76 147.080316883342 "C10H10O" 147.08044139346 0.659539575523873 0.846544359219698 | |
| 77 147.116706878527 "C11H14" 147.11682689876 0.628811018593558 0.815815807942072 | |
| 78 149.059468904565 "C9H8O2" 149.05970595196 1.40328022491653 1.59028486943581 | |
| 79 149.059955264357 "C9H8O2" 149.05970595196 1.85957260207492 1.67256734740101 | |
| 80 149.096105311228 "C10H12O" 149.09609145726 0.279924685552824 0.0929197262252704 | |
| 81 149.132268466222 "C11H16" 149.13247696256 1.21105657506476 1.39806125557997 | |
| 82 149.132268748331 "C11H16" 149.13247696256 1.2091649075899 1.39616958848627 | |
| 83 149.132512576788 "C11H16" 149.13247696256 0.425814324006438 0.238809337419294 | |
| 84 151.038974157049 "C8H6O3" 151.03897051046 0.211148311679211 0.0241433651827133 | |
| 85 151.038974157078 "C8H6O3" 151.03897051046 0.211148503617381 0.0241435571208835 | |
| 86 151.075099630601 "C9H10O2" 151.07535601576 1.51006341997452 1.6970680445913 | |
| 87 151.075347279301 "C9H10O2" 151.07535601576 0.129176445846273 0.0578284852332326 | |
| 88 151.075347569279 "C9H10O2" 151.07535601576 0.131095872285796 0.0559090591699681 | |
| 89 151.075348189833 "C9H10O2" 151.07535601576 0.135203452335112 0.0518014798731703 | |
| 90 151.075348501832 "C9H10O2" 151.07535601576 0.137268640647124 0.0497362919374166 | |
| 91 151.075349373157 "C9H10O2" 151.07535601576 0.143036127768892 0.0439688059444243 | |
| 92 151.111735640747 "C10H14O" 151.11174152106 0.148091261089388 0.03891367357704 | |
| 93 153.054619927045 "C8H8O3" 153.05462057426 0.182776287362526 0.00422865389591792 | |
| 94 153.054620565435 "C8H8O3" 153.05462057426 0.186947282676669 5.76593245611096e-05 | |
| 95 153.090962015696 "C9H12O2" 153.09100607956 0.10082301980466 0.287827907977257 | |
| 96 153.127316094464 "C10H16O" 153.12739158486 0.305985954931795 0.492990804706826 | |
| 97 153.127570993099 "C10H16O" 153.12739158486 1.35863250445293 1.17162734341284 | |
| 98 153.127571565923 "C10H16O" 153.12739158486 1.36237333824271 1.17536817646018 | |
| 99 155.070453044212 "C8H10O3" 155.07027063806 1.36328576843742 1.17628060647648 | |
| 100 155.106737838899 "C9H14O2" 155.10665614336 0.713710605662689 0.526705565230902 | |
| 101 155.106738159445 "C9H14O2" 155.10665614336 0.715777222739794 0.528772181941527 | |
| 102 155.106738473722 "C9H14O2" 155.10665614336 0.717803422435552 0.530798381270805 | |
| 103 157.08579578477 "C8H12O3" 157.08592070186 0.608210267633585 0.795215060949788 | |
| 104 157.085946439803 "C8H12O3" 157.08592070186 0.3508512478044 0.163846275185597 | |
| 105 157.085947048667 "C8H12O3" 157.08592070186 0.354727242065349 0.167722268722821 | |
| 106 157.121883176681 "C9H16O2" 157.12230620716 2.50535980447118 2.69236424292772 | |
| 107 157.12214778151 "C9H16O2" 157.12230620716 0.821290337388313 1.00829509077275 | |
| 108 157.122412358733 "C9H16O2" 157.12230620716 0.862603432131068 0.675598363818745 | |
| 109 157.122412358791 "C9H16O2" 157.12230620716 0.86260380132568 0.675598733013358 | |
| 110 159.080393298643 "C11H10O" 159.08044139346 0.1153252853055 0.302330170713288 | |
| 111 161.059565775509 "C10H8O2" 161.05970595196 0.683333647173868 0.870338426347772 | |
| 112 161.059841052847 "C10H8O2" 161.05970595196 1.02582996920003 0.838824870444545 | |
| 113 161.096053241534 "C11H12O" 161.09609145726 0.050218275521541 0.237223173124809 | |
| 114 163.038746167739 "C9H6O3" 163.03897051046 1.1890020473964 1.37600673198062 | |
| 115 163.03874778808 "C9H6O3" 163.03897051046 1.17906367918065 1.36606836568244 | |
| 116 163.039025195836 "C9H6O3" 163.03897051046 0.522417917451159 0.335412912806903 | |
| 117 163.039025865484 "C9H6O3" 163.03897051046 0.526525206383673 0.339520200867794 | |
| 118 163.039028106743 "C9H6O3" 163.03897051046 0.540271977316634 0.35326696936021 | |
| 119 163.039028106758 "C9H6O3" 163.03897051046 0.540272069360042 0.353267061403619 | |
| 120 163.039029044666 "C9H6O3" 163.03897051046 0.546024732017276 0.35901972284058 | |
| 121 163.075347751637 "C10H10O2" 163.07535601576 0.136328219506617 0.0506767129792754 | |
| 122 163.075348431731 "C10H10O2" 163.07535601576 0.140498648127701 0.0465062852296196 | |
| 123 163.075348762482 "C10H10O2" 163.07535601576 0.142526858190597 0.0444780755152955 | |
| 124 163.075349063808 "C10H10O2" 163.07535601576 0.14437463005048 0.0426303040039832 | |
| 125 163.075627543535 "C10H10O2" 163.07535601576 1.85205006227625 1.66504480893031 | |
| 126 163.111683131241 "C11H14O" 163.11174152106 0.17096947104674 0.357974346043198 | |
| 127 163.111683432606 "C11H14O" 163.11174152106 0.169121872304544 0.356126747649495 | |
| 128 165.054632733924 "C9H8O3" 165.05462057426 0.260675501465258 0.0736705457816718 | |
| 129 165.054633050795 "C9H8O3" 165.05462057426 0.262595296566792 0.0755903405388142 | |
| 130 165.054917933159 "C9H8O3" 165.05462057426 1.98858404085715 1.80157876196208 | |
| 131 165.091062684938 "C10H12O2" 165.09100607956 0.529878790419471 0.342873784286866 | |
| 132 165.091063019601 "C10H12O2" 165.09100607956 0.531905933206439 0.344900926729518 | |
| 133 165.091063637205 "C10H12O2" 165.09100607956 0.535646925099767 0.348641917934215 | |
| 134 165.091063637292 "C10H12O2" 165.09100607956 0.535647452074885 0.348642444909333 | |
| 135 165.127220211145 "C11H16O" 165.12739158486 0.850822552299703 1.03782730024812 | |
| 136 167.069883439913 "C9H10O3" 167.07027063806 2.13057207465886 2.31757658329553 | |
| 137 167.070173905161 "C9H10O3" 167.07027063806 0.391990451548053 0.578995285280784 | |
| 138 167.070174588906 "C9H10O3" 167.07027063806 0.387897891420746 0.57490272583395 | |
| 139 167.070464677693 "C9H10O3" 167.07027063806 1.34843042200055 1.16142526283152 | |
| 140 167.106692449551 "C10H14O2" 167.10665614336 0.404268566397383 0.21726358381031 | |
| 141 167.106692449667 "C10H14O2" 167.10665614336 0.404269260669057 0.217264278081984 | |
| 142 167.142934262498 "C11H18O" 167.14304164866 0.455475779993021 0.642480601889134 | |
| 143 169.049393451754 "C8H8O4" 169.04953519656 0.651476112132036 0.838480897376082 | |
| 144 169.04939644615 "C8H8O4" 169.04953519656 0.633762981272238 0.820767769710688 | |
| 145 169.085972775605 "C9H12O3" 169.08592070186 0.494977093197876 0.307972093595359 | |
| 146 169.085973819499 "C9H12O3" 169.08592070186 0.501150843188232 0.314145842409083 | |
| 147 169.122267864849 "C10H16O2" 169.12230620716 0.0397086064979792 0.226713506105426 | |
| 148 169.122270213149 "C10H16O2" 169.12230620716 0.0258233865073915 0.212828288635651 | |
| 149 169.122270213265 "C10H16O2" 169.12230620716 0.0258227005102543 0.212827602638514 | |
| 150 171.080509850501 "C12H10O" 171.08044139346 0.587150354496429 0.400145337620699 | |
| 151 171.080510166407 "C12H10O" 171.08044139346 0.588996889819885 0.401991872611893 | |
| 152 171.101530018729 "C9H14O3" 171.10157076566 0.0511397953427729 0.238144692791884 | |
| 153 171.101531079244 "C9H14O3" 171.10157076566 0.0449416335595019 0.231946532171384 | |
| 154 171.137875509749 "C10H18O2" 171.13795627096 0.284902213203831 0.471907066994175 | |
| 155 171.137876913025 "C10H18O2" 171.13795627096 0.276702534485926 0.463707389770943 | |
| 156 171.137877229445 "C10H18O2" 171.13795627096 0.274853616435988 0.461858472053155 | |
| 157 171.137877553161 "C10H18O2" 171.13795627096 0.272962066143162 0.459966922092478 | |
| 158 173.080595889975 "C8H12O4" 173.08083532416 1.19636156027543 1.38336624361967 | |
| 159 173.080901779109 "C8H12O4" 173.08083532416 0.570958262415132 0.383953248679144 | |
| 160 173.095876488337 "C12H12O" 173.09609145726 1.05490041457581 1.24190512437212 | |
| 161 173.095877135651 "C12H12O" 173.09609145726 1.0511607917443 1.23816550219739 | |
| 162 173.132248282129 "C13H16" 173.13247696256 1.13383605657692 1.32084075149265 | |
| 163 173.13224860212 "C13H16" 173.13247696256 1.13198781267242 1.31899250791647 | |
| 164 173.1328603 "C13H16" 173.13247696256 2.4011332119483 2.21412785595369 | |
| 165 148.083550145682 "C10H10O" 148.08379639346 1.47589018931293 1.66289482030857 | |
| 166 148.083550145682 "C10H10O" 148.08379639346 1.47589018931293 1.66289482030857 | |
| 167 148.083550145682 "C10H10O" 148.08379639346 1.47589018931293 1.66289482030857 | |
| 168 150.099338738694 "C10H12O" 150.09944645726 0.530643181968845 0.717647989662112 | |
| 169 152.04228982968 "C8H6O3" 152.04232551046 0.0476717282591848 0.234676626274422 | |
| 170 152.04228982968 "C8H6O3" 152.04232551046 0.0476717282591848 0.234676626274422 | |
| 171 152.078775254603 "C9H10O2" 152.07871101576 0.609410251510487 0.422405230501694 | |
| 172 152.078775254603 "C9H10O2" 152.07871101576 0.609410251510487 0.422405230501694 | |
| 173 152.078775254603 "C9H10O2" 152.07871101576 0.609410251510487 0.422405230501694 | |
| 174 152.078775254603 "C9H10O2" 152.07871101576 0.609410251510487 0.422405230501694 | |
| 175 152.078775254603 "C9H10O2" 152.07871101576 0.609410251510487 0.422405230501694 | |
| 176 152.078775254603 "C9H10O2" 152.07871101576 0.609410251510487 0.422405230501694 | |
| 177 152.115022338309 "C10H14O" 152.11509652106 0.300670289311685 0.487675140097821 | |
| 178 154.057848301939 "C8H8O3" 154.05797557426 0.639127845537439 0.826132633087455 | |
| 179 154.057848301939 "C8H8O3" 154.05797557426 0.639127845537439 0.826132633087455 | |
| 180 154.094290985006 "C9H12O2" 154.09436107956 0.267875863536499 0.454880720484245 | |
| 181 154.130490423154 "C10H16O" 154.13074658486 1.47497204573425 1.66197667682257 | |
| 182 154.130490423154 "C10H16O" 154.13074658486 1.47497204573425 1.66197667682257 | |
| 183 154.130490423154 "C10H16O" 154.13074658486 1.47497204573425 1.66197667682257 | |
| 184 164.042329495914 "C9H6O3" 164.04232551046 0.211300225220136 0.0242952786874248 | |
| 185 164.042329495914 "C9H6O3" 164.04232551046 0.211300225220136 0.0242952786874248 | |
| 186 164.042350246799 "C9H6O3" 164.04232551046 0.337797388683429 0.150792418587577 | |
| 187 164.042350246799 "C9H6O3" 164.04232551046 0.337797388683429 0.150792418587577 | |
| 188 164.042350246799 "C9H6O3" 164.04232551046 0.337797388683429 0.150792418587577 | |
| 189 164.042350246799 "C9H6O3" 164.04232551046 0.337797388683429 0.150792418587577 | |
| 190 164.042350246799 "C9H6O3" 164.04232551046 0.337797388683429 0.150792418587577 | |
| 191 164.078703575507 "C10H10O2" 164.07871101576 0.141659300626031 0.0453456329240267 | |
| 192 164.078703575507 "C10H10O2" 164.07871101576 0.141659300626031 0.0453456329240267 | |
| 193 164.078703575507 "C10H10O2" 164.07871101576 0.141659300626031 0.0453456329240267 | |
| 194 164.078703575507 "C10H10O2" 164.07871101576 0.141659300626031 0.0453456329240267 | |
| 195 164.078703575507 "C10H10O2" 164.07871101576 0.141659300626031 0.0453456329240267 | |
| 196 164.115092017902 "C11H14O" 164.11509652106 0.159565913231019 0.0274390236212101 | |
| 197 164.115092017902 "C11H14O" 164.11509652106 0.159565913231019 0.0274390236212101 | |
| 198 166.05809385444 "C9H8O3" 166.05797557426 0.899287514917901 0.712282439712346 | |
| 199 166.05809385444 "C9H8O3" 166.05797557426 0.899287514917901 0.712282439712346 | |
| 200 166.05809385444 "C9H8O3" 166.05797557426 0.899287514917901 0.712282439712346 | |
| 201 166.094148326901 "C10H12O2" 166.09436107956 1.09390969829299 1.28091440078442 | |
| 202 166.094148326901 "C10H12O2" 166.09436107956 1.09390969829299 1.28091440078442 | |
| 203 166.094148326901 "C10H12O2" 166.09436107956 1.09390969829299 1.28091440078442 | |
| 204 166.094148326901 "C10H12O2" 166.09436107956 1.09390969829299 1.28091440078442 | |
| 205 168.073832371366 "C9H10O3" 168.07362563806 1.41702151281288 1.23001634076821 | |
| 206 168.073832371366 "C9H10O3" 168.07362563806 1.41702151281288 1.23001634076821 | |
| 207 168.073832371366 "C9H10O3" 168.07362563806 1.41702151281288 1.23001634076821 | |
| 208 168.110096210011 "C10H14O2" 168.11001114336 0.693022794939735 0.506017758357209 | |
| 209 168.110096210011 "C10H14O2" 168.11001114336 0.693022794939735 0.506017758357209 | |
| 210 170.089422178279 "C9H12O3" 170.08927570186 1.04817885064429 0.861173747645385 | |
| 211 170.089422178279 "C9H12O3" 170.08927570186 1.04817885064429 0.861173747645385 | |
| 212 170.125448166927 "C10H16O2" 170.12566120716 1.06524748909472 1.25225219696461 | |
| 213 170.125448166927 "C10H16O2" 170.12566120716 1.06524748909472 1.25225219696461 | |
| 214 170.125448166927 "C10H16O2" 170.12566120716 1.06524748909472 1.25225219696461 | |
| 215 172.104822618375 "C9H14O3" 172.10492576566 0.412323077294344 0.599327907263285 | |
| 216 172.104822618375 "C9H14O3" 172.10492576566 0.412323077294344 0.599327907263285 | |
| 217 175.075546676806 "C11H10O2" 175.07535601576 1.57711869095567 1.08902275186023 | |
| 218 175.111612481644 "C12H14O" 175.11174152106 0.248802517579896 0.736897565454639 | |
| 219 175.111613136819 "C12H14O" 175.11174152106 0.245061047662331 0.733156097322441 | |
| 220 175.147998308558 "C13H18" 175.14812702636 0.246813192422882 0.7349082412964 | |
| 221 175.147999717578 "C13H18" 175.14812702636 0.238768455050221 0.726863507818276 | |
| 222 175.147999717724 "C13H18" 175.14812702636 0.238767621456829 0.726862674224884 | |
| 223 175.148310441846 "C13H18" 175.14812702636 1.53529801629823 1.04720209764457 | |
| 224 177.05459583337 "C10H8O3" 177.05462057426 0.348359420929876 0.139735918396306 | |
| 225 177.090640294028 "C11H12O2" 177.09100607956 1.57742852087035 2.06552292015922 | |
| 226 177.090957255896 "C11H12O2" 177.09100607956 0.212397115979836 0.275698157028086 | |
| 227 177.127013874068 "C12H16O" 177.12739158486 1.64433014764691 2.1324245143602 | |
| 228 177.127330536075 "C12H16O" 177.12739158486 0.143434910622448 0.344660328667667 | |
| 229 177.127330871385 "C12H16O" 177.12739158486 0.145327955922045 0.342767284330825 | |
| 230 177.1633986 "C13H20" 177.16377709016 1.64829133567939 2.1363857004719 | |
| 231 177.163714368589 "C13H20" 177.16377709016 0.134063659997573 0.354031574786151 | |
| 232 177.163715031585 "C13H20" 177.16377709016 0.137805939174156 0.350289297374256 | |
| 233 177.163715381495 "C13H20" 177.16377709016 0.139781005173288 0.348314232337682 | |
| 234 179.0702823 "C10H10O3" 179.07027063806 0.553220375796878 0.0651249364380387 | |
| 235 179.070335262278 "C10H10O3" 179.07027063806 0.848983059639468 0.360887476005793 | |
| 236 179.10662494346 "C11H14O2" 179.10665614336 0.313897999645619 0.174197322865418 | |
| 237 179.106626007619 "C11H14O2" 179.10665614336 0.319839484773753 0.16825584059363 | |
| 238 179.14297825563 "C12H18O" 179.14304164866 0.13422701074633 0.353868223998 | |
| 239 179.142978255892 "C12H18O" 179.14304164866 0.134228473216293 0.353866761528037 | |
| 240 179.142978948689 "C12H18O" 179.14304164866 0.138095759106296 0.349999477541878 | |
| 241 179.143301 "C12H18O" 179.14304164866 1.93582937599084 1.44773326182896 | |
| 242 179.143301035373 "C12H18O" 179.14304164866 1.93602683291663 1.44793071859609 | |
| 243 181.049635523905 "C9H8O4" 181.04953519656 1.04223874677015 0.554143068717744 | |
| 244 181.121900070031 "C11H16O2" 181.12230620716 1.75424202584743 2.24233633896216 | |
| 245 181.122227868664 "C11H16O2" 181.12230620716 0.0555780888539829 0.432517107563338 | |
| 246 181.158541822123 "C12H20O" 181.15869171246 0.339302984303676 0.827397987899543 | |
| 247 183.080265933829 "C13H10O" 183.08044139346 0.470279584941815 0.958374524738048 | |
| 248 183.0805983 "C13H10O" 183.08044139346 1.34513188483171 0.857036059071394 | |
| 249 183.101540976288 "C10H14O3" 183.10157076566 0.325402174346796 0.162693153765989 | |
| 250 183.101541686054 "C10H14O3" 183.10157076566 0.329278527438447 0.158816802537023 | |
| 251 183.137787042488 "C11H18O2" 183.13795627096 0.435954188966074 0.924049145515437 | |
| 252 185.080698695242 "C9H12O4" 185.08083532416 0.250117084669296 0.738212131799146 | |
| 253 185.081036963993 "C9H12O4" 185.08083532416 1.57756494157478 1.08946900223947 | |
| 254 185.117196150203 "C10H16O3" 185.11722082946 0.354778426313144 0.133316916085712 | |
| 255 185.153365518928 "C11H20O2" 185.15360633476 0.812532510589009 1.30062728330262 | |
| 256 185.15370431283 "C11H20O2" 185.15360633476 1.01726748117419 0.529171815377754 | |
| 257 185.15370575437 "C11H20O2" 185.15360633476 1.0250531287046 0.536957459070574 | |
| 258 187.0756398 "C12H10O2" 187.07535601576 2.00504763761256 1.51695148971449 | |
| 259 187.096242074815 "C9H14O4" 187.09648538796 0.812374044162327 1.30046881694015 | |
| 260 187.096584719501 "C9H14O4" 187.09648538796 1.01900644669763 0.530910780085066 | |
| 261 187.096585874517 "C9H14O4" 187.09648538796 1.0251798205362 0.537084150885448 | |
| 262 187.111354631899 "C13H14O" 187.11174152106 1.57959605158757 2.06769044989769 | |
| 263 189.09044750283 "C12H12O2" 189.09100607956 2.46591607206236 2.95401003778927 | |
| 264 189.091144991185 "C12H12O2" 189.09100607956 1.22272417528639 0.73462840918175 | |
| 265 189.127435633917 "C13H16O" 189.12739158486 0.721002328819451 0.232906807632771 | |
| 266 191.070268815373 "C11H10O3" 191.07027063806 0.478556048502808 0.00953935431719782 | |
| 267 191.106423618302 "C12H14O2" 191.10665614336 0.728634434273902 1.21672924796266 | |
| 268 191.106424400424 "C12H14O2" 191.10665614336 0.724541838022057 1.2126366536442 | |
| 269 191.106424400511 "C12H14O2" 191.10665614336 0.724541382784891 1.21263619840703 | |
| 270 191.106425115313 "C12H14O2" 191.10665614336 0.720801050866582 1.20889586827338 | |
| 271 191.142944475175 "C13H18O" 191.14304164866 0.0202858110269772 0.508380970346822 | |
| 272 193.049309403287 "C10H8O4" 193.04953519656 0.68151830315227 1.16961313975242 | |
| 273 193.049669336381 "C10H8O4" 193.04953519656 1.18294238719486 0.694846640597248 | |
| 274 193.085668574628 "C11H12O3" 193.08592070186 0.817682632490644 1.30577740262027 | |
| 275 193.08566932306 "C11H12O3" 193.08592070186 0.813806470170882 1.30190124221408 | |
| 276 193.122037213345 "C12H16O2" 193.12230620716 0.904772933588966 1.39286766126175 | |
| 277 193.12203760483 "C12H16O2" 193.12230620716 0.90274579747363 1.3908405261766 | |
| 278 193.122038327259 "C12H16O2" 193.12230620716 0.899005010952851 1.38709974142185 | |
| 279 193.158416876848 "C13H20O" 193.15869171246 0.93475408328801 1.42284879632973 | |
| 280 193.158777480649 "C13H20O" 193.15869171246 0.932125288371663 0.444029664081038 | |
| 281 193.158778623119 "C13H20O" 193.15869171246 0.938039961500735 0.449944334414418 | |
| 282 193.159138101845 "C13H20O" 193.15869171246 2.79909471549564 2.31099817995611 | |
| 283 195.065107 "C10H10O4" 195.06518526036 0.0868941469977455 0.401201064629947 | |
| 284 195.06510701891 "C10H10O4" 195.06518526036 0.0869910890269552 0.401104122746441 | |
| 285 195.065107019056 "C10H10O4" 195.06518526036 0.0869918375066039 0.401103374266792 | |
| 286 195.101305796369 "C11H14O3" 195.10157076566 0.870014726141773 1.35810947072271 | |
| 287 195.101306595016 "C11H14O3" 195.10157076566 0.865921230548361 1.35401597716877 | |
| 288 195.101306955531 "C11H14O3" 195.10157076566 0.864073397425165 1.35216814491963 | |
| 289 195.101673011887 "C11H14O3" 195.10157076566 1.01216231534295 0.524066651980471 | |
| 290 195.137880437045 "C12H18O2" 195.13795627096 0.0994782801949129 0.388616937679763 | |
| 291 195.137880797773 "C12H18O2" 195.13795627096 0.101326860411975 0.386768358336597 | |
| 292 195.137881167072 "C12H18O2" 195.13795627096 0.103219363510008 0.38487585611246 | |
| 293 195.174098672467 "C13H22O" 195.17434177626 0.757477701401122 1.2455725008942 | |
| 294 195.174464925586 "C13H22O" 195.17434177626 1.11906659444493 0.630970878988456 | |
| 295 197.095936886287 "C14H12O" 197.09609145726 0.296146671063617 0.784241695776268 | |
| 296 197.117101322122 "C11H16O3" 197.11722082946 0.118180369974241 0.606275481573011 | |
| 297 197.117102086062 "C11H16O3" 197.11722082946 0.114304806184338 0.602399919657537 | |
| 298 197.153501295288 "C12H20O2" 197.15360633476 0.0446847186949027 0.532779866200145 | |
| 299 197.153501667965 "C12H20O2" 197.15360633476 0.0427944303521019 0.530889578722305 | |
| 300 197.1535020573 "C12H20O2" 197.15360633476 0.0408196494095953 0.52891479878892 | |
| 301 197.189594388953 "C13H24O" 197.18999184006 1.52748001444784 2.01557443811793 | |
| 302 199.096425160656 "C10H14O4" 199.09648538796 0.185592159947071 0.302503099876914 | |
| 303 199.096425978722 "C10H14O4" 199.09648538796 0.189701054232486 0.298394207590047 | |
| 304 199.096426389748 "C10H14O4" 199.09648538796 0.191765511460977 0.29632975136083 | |
| 305 199.096426389777 "C10H14O4" 199.09648538796 0.191765657212246 0.296329605609561 | |
| 306 199.13262185615 "C11H18O3" 199.13287089326 0.7625129447613 1.25060774184656 | |
| 307 199.132998567627 "C11H18O3" 199.13287089326 1.12924736181906 0.641151641287761 | |
| 308 199.132999312453 "C11H18O3" 199.13287089326 1.13298771033186 0.644891988087834 | |
| 309 199.168827191644 "C12H22O2" 199.16925639856 1.66689142766855 2.15498578330395 | |
| 310 199.169204374221 "C12H22O2" 199.16925639856 0.226888606196865 0.261206673857479 | |
| 311 199.169205565725 "C12H22O2" 199.16925639856 0.232870978113433 0.255224304794936 | |
| 312 201.1118374 "C10H16O4" 201.11213545176 0.993923093165771 1.48201777736708 | |
| 313 201.11183742187 "C10H16O4" 201.11213545176 0.993814347894051 1.48190903209536 | |
| 314 201.11222133208 "C10H16O4" 201.11213545176 0.915122656390843 0.427027040448994 | |
| 315 201.112221332138 "C10H16O4" 201.11213545176 0.915122944830468 0.427027328888619 | |
| 316 201.127530486583 "C14H16O" 201.12739158486 1.17871138827569 0.690615643701327 | |
| 317 203.1067260631 "C13H14O2" 203.10665614336 0.832346922822993 0.344251347254961 | |
| 318 203.142875188634 "C14H18O" 203.14304164866 0.33132772344163 0.819422731042801 | |
| 319 203.179013842862 "C15H22" 203.17942715396 1.54612284741557 2.03421726207404 | |
| 320 176.114988480169 "C12H14O" 176.11509652106 0.125372409187932 0.613467517215949 | |
| 321 176.114988480169 "C12H14O" 176.11509652106 0.125372409187932 0.613467517215949 | |
| 322 180.109548958183 "C11H14O2" 180.11001114336 2.07803292512186 2.56612708006334 | |
| 323 180.109548958183 "C11H14O2" 180.11001114336 2.07803292512186 2.56612708006334 | |
| 324 182.125659378633 "C11H16O2" 182.12566120716 0.478055483073374 0.0100399195706221 | |
| 325 182.125659378633 "C11H16O2" 182.12566120716 0.478055483073374 0.0100399195706221 | |
| 326 184.14093655924 "C11H18O2" 184.14131127096 1.54681951888934 2.03491393321113 | |
| 327 186.120659441291 "C10H16O3" 186.12057582946 0.937330380278179 0.449234753488673 | |
| 328 190.094427496074 "C12H12O2" 190.09436107956 0.837482659368174 0.349387081294277 | |
| 329 192.073289242579 "C11H10O3" 192.07362563806 1.26329364486071 1.75138819760683 | |
| 330 192.110086432852 "C12H14O2" 192.11001114336 0.8800038161856 0.391908217351855 | |
| 331 192.110086432852 "C12H14O2" 192.11001114336 0.8800038161856 0.391908217351855 | |
| 332 192.110086432852 "C12H14O2" 192.11001114336 0.8800038161856 0.391908217351855 | |
| 333 192.110086432852 "C12H14O2" 192.11001114336 0.8800038161856 0.391908217351855 | |
| 334 194.052738134241 "C10H8O4" 194.05289019656 0.295517725310321 0.783612750291858 | |
| 335 194.052738134241 "C10H8O4" 194.05289019656 0.295517725310321 0.783612750291858 | |
| 336 194.089019073039 "C11H12O3" 194.08927570186 0.83412574734041 1.32222050949582 | |
| 337 194.089019073039 "C11H12O3" 194.08927570186 0.83412574734041 1.32222050949582 | |
| 338 194.125307872791 "C12H16O2" 194.12566120716 1.33203769199332 1.82013221118632 | |
| 339 194.125307872791 "C12H16O2" 194.12566120716 1.33203769199332 1.82013221118632 | |
| 340 194.125307872791 "C12H16O2" 194.12566120716 1.33203769199332 1.82013221118632 | |
| 341 196.068471335955 "C10H10O4" 196.06854026036 0.136563037478786 0.351532198495888 | |
| 342 196.068471335955 "C10H10O4" 196.06854026036 0.136563037478786 0.351532198495888 | |
| 343 196.068471335955 "C10H10O4" 196.06854026036 0.136563037478786 0.351532198495888 | |
| 344 196.141070519234 "C12H18O2" 196.14131127096 0.739345369329162 1.22744017781141 | |
| 345 196.141070519234 "C12H18O2" 196.14131127096 0.739345369329162 1.22744017781141 | |
| 346 196.141070519234 "C12H18O2" 196.14131127096 0.739345369329162 1.22744017781141 | |
| 347 198.099316239164 "C14H12O" 198.09944645726 0.169241914147356 0.657337000776378 | |
| 348 198.120642908004 "C11H16O3" 198.12057582946 0.826669916727958 0.338574343989283 | |
| 349 198.120642908004 "C11H16O3" 198.12057582946 0.826669916727958 0.338574343989283 | |
| 350 200.099945817696 "C10H14O4" 200.09984038796 1.01498132237499 0.526885657707169 | |
| 351 200.099945817696 "C10H14O4" 200.09984038796 1.01498132237499 0.526885657707169 | |
| 352 200.099945817696 "C10H14O4" 200.09984038796 1.01498132237499 0.526885657707169 | |
| 353 200.099945817696 "C10H14O4" 200.09984038796 1.01498132237499 0.526885657707169 | |
| 354 200.136035000942 "C11H18O3" 200.13622589326 0.465716978515561 0.953811920537116 | |
| 355 200.136035000942 "C11H18O3" 200.13622589326 0.465716978515561 0.953811920537116 | |
| 356 200.136035000942 "C11H18O3" 200.13622589326 0.465716978515561 0.953811920537116 | |
| 357 202.115229039964 "C10H16O4" 202.11549045176 0.805283556204988 1.29337833245383 | |
| 358 202.115229039964 "C10H16O4" 202.11549045176 0.805283556204988 1.29337833245383 | |
| 359 202.115229039964 "C10H16O4" 202.11549045176 0.805283556204988 1.29337833245383 | |
| 360 202.115229039964 "C10H16O4" 202.11549045176 0.805283556204988 1.29337833245383 | |
| 361 204.109470048704 "C13H14O2" 204.11001114336 2.16290106769228 2.65099518132136 | |
| 362 204.146258334786 "C14H18O" 204.14639664866 0.189427898097286 0.677522974914368 | |
| 363 204.18266549657 "C15H22" 204.18278215396 0.0832429086999016 0.571338037314818 | |
| 364 205.085738556457 "C12H12O3" 205.08592070186 0.00168092290306923 0.888141918241238 | |
| 365 205.085741375682 "C12H12O3" 205.08592070186 0.0120656449181373 0.874395362615459 | |
| 366 205.122003913835 "C13H16O2" 205.12230620716 0.587261863355211 1.47372233959399 | |
| 367 205.158277263762 "C14H20O" 205.15869171246 1.13367717402272 2.02013716584151 | |
| 368 205.15867079764 "C14H20O" 205.15869171246 0.784517096065776 0.101944596273139 | |
| 369 205.158671202293 "C14H20O" 205.15869171246 0.786489487862836 0.0999722061385015 | |
| 370 207.065405522783 "C11H10O4" 207.06518526036 1.95019742690874 1.06373470133323 | |
| 371 207.101395772749 "C12H14O3" 207.10157076566 0.0414992578121398 0.844961775839516 | |
| 372 207.101396575707 "C12H14O3" 207.10157076566 0.0453763831026614 0.841084653979885 | |
| 373 207.137794594515 "C13H18O2" 207.13795627096 0.105935648043261 0.780525442627865 | |
| 374 207.13779459501 "C13H18O2" 207.13795627096 0.105938037855935 0.780523052815192 | |
| 375 207.137795825512 "C13H18O2" 207.13795627096 0.111878538207638 0.774582557814737 | |
| 376 207.137796217575 "C13H18O2" 207.13795627096 0.113771302501732 0.772689795167182 | |
| 377 207.137796217721 "C13H18O2" 207.13795627096 0.113772007357201 0.772689090311712 | |
| 378 207.173806140478 "C14H22O" 207.17434177626 1.69897544976497 2.58543494048611 | |
| 379 209.044265184133 "C10H8O5" 209.04444981886 0.00322909782451113 0.883231901884052 | |
| 380 209.059679718072 "C14H8O2" 209.05970595196 0.760976524042892 0.125485147356602 | |
| 381 209.080771734896 "C11H12O4" 209.08083532416 0.582324293060692 0.304137220025851 | |
| 382 209.080771735071 "C11H12O4" 209.08083532416 0.582325130157437 0.304136382929106 | |
| 383 209.080772175221 "C11H12O4" 209.08083532416 0.58443029851562 0.302031216338097 | |
| 384 209.080773 "C11H12O4" 209.08083532416 0.588375087291849 0.298086431096217 | |
| 385 209.116883794103 "C12H16O3" 209.11722082946 0.72524506028754 1.61170541416627 | |
| 386 209.116884180701 "C12H16O3" 209.11722082946 0.723396344323761 1.60985669983344 | |
| 387 209.116885382019 "C12H16O3" 209.11722082946 0.717651628086549 1.60411198876092 | |
| 388 209.117288729704 "C12H16O3" 209.11722082946 1.21116150810229 0.324699437644752 | |
| 389 209.117289585659 "C12H16O3" 209.11722082946 1.21525469448831 0.328792620361122 | |
| 390 209.117290780975 "C12H16O3" 209.11722082946 1.2209707089298 0.334508629773839 | |
| 391 209.15340895383 "C13H20O2" 209.15360633476 0.0572518278193127 0.943712773961358 | |
| 392 209.153409809934 "C13H20O2" 209.15360633476 0.0531586411753714 0.939619590850536 | |
| 393 209.153409810341 "C13H20O2" 209.15360633476 0.0531566952424938 0.939617644917658 | |
| 394 209.153410196832 "C13H20O2" 209.15360633476 0.051308812514171 0.937769763820005 | |
| 395 209.153410592301 "C13H20O2" 209.15360633476 0.0494180043003045 0.935878957372698 | |
| 396 209.153411005601 "C13H20O2" 209.15360633476 0.0474419428917982 0.933902897730751 | |
| 397 211.059857416649 "C10H10O5" 211.06009988266 0.262340032897497 1.14880079719998 | |
| 398 211.096482130755 "C11H14O4" 211.09648538796 0.871031834148697 0.0154299348131533 | |
| 399 211.096482949109 "C11H14O4" 211.09648538796 0.874908519958009 0.0115532525044422 | |
| 400 211.132704705632 "C12H18O3" 211.13287089326 0.0993376621599484 0.787123422770219 | |
| 401 211.132704705894 "C12H18O3" 211.13287089326 0.0993389031781666 0.787122181752001 | |
| 402 211.13270513386 "C12H18O3" 211.13287089326 0.101365903235835 0.785095183444331 | |
| 403 211.132705524301 "C12H18O3" 211.13287089326 0.103215171688518 0.783245916607031 | |
| 404 211.16893742342 "C13H22O2" 211.16925639856 0.624058395319041 1.51051883898435 | |
| 405 211.169071837655 "C13H22O2" 211.16925639856 0.0124658621811931 0.873995145694111 | |
| 406 213.111838165792 "C11H16O4" 213.11213545176 0.508513829169812 1.39497437521627 | |
| 407 213.111838606061 "C11H16O4" 213.11213545176 0.506447924211212 1.39290847212478 | |
| 408 213.111839432109 "C11H16O4" 213.11213545176 0.502571801757347 1.38903235313841 | |
| 409 213.111868075664 "C11H16O4" 213.11213545176 0.368165657696311 1.25462632817236 | |
| 410 213.148164019479 "C12H20O3" 213.14852095706 0.788135328308807 1.6745956264964 | |
| 411 213.14816441353 "C12H20O3" 213.14852095706 0.78628661108984 1.67274691087754 | |
| 412 213.148582398839 "C12H20O3" 213.14852095706 1.17472009761556 0.288258059444571 | |
| 413 213.184915977759 "C13H24O2" 213.18490646236 0.931096309530919 0.0446344873011579 | |
| 414 215.127422324474 "C11H18O4" 215.12778551556 0.80179716114566 1.68825744719466 | |
| 415 215.127844902766 "C11H18O4" 215.12778551556 1.16251751617179 0.276055488840834 | |
| 416 217.121904200937 "C14H16O2" 217.12230620716 0.965059539129254 1.85151968040903 | |
| 417 217.122333915963 "C14H16O2" 217.12230620716 1.01408030349799 0.12761840774085 | |
| 418 217.1223343268 "C14H16O2" 217.12230620716 1.01597249679764 0.12951059933878 | |
| 419 217.158400021856 "C15H20O" 217.15869171246 0.456753449782502 1.3432140417736 | |
| 420 217.158830696782 "C15H20O" 217.15869171246 1.52647505626486 0.640012706294855 | |
| 421 219.101161038611 "C13H14O3" 219.10157076566 0.983572333391695 1.8700324583331 | |
| 422 219.137723042578 "C14H18O2" 219.13795627096 0.177838499812461 1.0642993389636 | |
| 423 219.137723457462 "C14H18O2" 219.13795627096 0.17594524327353 1.06240608411074 | |
| 424 219.174292944745 "C15H22O" 219.17434177626 0.66366399570649 0.222797589447282 | |
| 425 221.080695673679 "C12H12O4" 221.08083532416 0.254789640703607 0.631671582018452 | |
| 426 221.116873599366 "C13H16O3" 221.11722082946 0.683883577642658 1.57034396825793 | |
| 427 221.153498294039 "C14H20O2" 221.15360633476 0.397928863853736 0.48853248566626 | |
| 428 221.189691088034 "C15H24O" 221.18999184006 0.473239395983575 1.35969997327116 | |
| 429 221.190133378424 "C15H24O" 221.18999184006 1.5263573235424 0.639894973672431 | |
| 430 223.074691790747 "C15H10O2" 223.07535601576 2.09112217680127 2.97758131987558 | |
| 431 223.075110179914 "C15H10O2" 223.07535601576 0.215569693743196 1.10203049949919 | |
| 432 223.075114838962 "C15H10O2" 223.07535601576 0.194684140891996 1.08114496512223 | |
| 433 223.09612279522 "C12H14O4" 223.09648538796 0.738812863865771 1.62527320577542 | |
| 434 223.096123660197 "C12H14O4" 223.09648538796 0.734935717272502 1.62139606262186 | |
| 435 223.132794410047 "C13H18O3" 223.13287089326 0.543691663335514 0.342769815459039 | |
| 436 223.169028076179 "C14H22O2" 223.16925639856 0.136629780643497 1.02309065641098 | |
| 437 223.169028517018 "C14H22O2" 223.16925639856 0.134654421700949 1.02111529912404 | |
| 438 223.1690289 "C14H22O2" 223.16925639856 0.132938314644793 1.01939919359615 | |
| 439 225.075783832446 "C11H12O5" 225.07574994646 1.03701561192284 0.150553695844466 | |
| 440 225.112038668167 "C12H16O4" 225.11213545176 0.456526370246511 0.429935031267486 | |
| 441 225.112039589733 "C12H16O4" 225.11213545176 0.460620182519244 0.425841222656171 | |
| 442 225.112040005725 "C12H16O4" 225.11213545176 0.462468116482127 0.423993290334613 | |
| 443 225.148302261493 "C13H20O3" 225.14852095706 0.084878201841258 0.971339123419449 | |
| 444 225.1483031034 "C13H20O3" 225.14852095706 0.0811388580025327 0.967599782862844 | |
| 445 225.184575869872 "C14H24O2" 225.18490646236 0.581632976799634 1.46809345797619 | |
| 446 227.127382267807 "C12H18O4" 227.12778551556 0.888962168854 1.77542237762495 | |
| 447 227.127382687583 "C12H18O4" 227.12778551556 0.887113974150936 1.77357418454865 | |
| 448 227.127878381111 "C12H18O4" 227.12778551556 1.29533132331812 0.408869178203138 | |
| 449 227.163675302016 "C13H22O3" 227.16417102086 1.29574539038637 2.1822052385269 | |
| 450 229.122456513599 "C15H16O2" 229.12230620716 1.5424719927201 0.656009628589352 | |
| 451 229.143400253236 "C12H20O4" 229.14343557936 0.732295658598941 0.154165987356109 | |
| 452 229.143400253673 "C12H20O4" 229.14343557936 0.732297565754619 0.154164080200432 | |
| 453 229.143401110495 "C12H20O4" 229.14343557936 0.736036807786408 0.150424841517576 | |
| 454 231.137308283031 "C15H18O2" 231.13795627096 1.91700898384017 2.80346828125518 | |
| 455 231.138251377798 "C15H18O2" 231.13795627096 2.16321919790825 1.27675628349932 | |
| 456 233.117227402223 "C14H16O3" 233.11722082946 0.914656906088738 0.0281950984803742 | |
| 457 233.1530547 "C15H20O2" 233.15360633476 1.47951169589796 2.36597138115342 | |
| 458 233.153532445899 "C15H20O2" 233.15360633476 0.56955085137648 0.316910650329077 | |
| 459 208.140734794865 "C13H18O2" 208.14131127096 1.88317872020336 2.76963804761896 | |
| 460 208.140734794865 "C13H18O2" 208.14131127096 1.88317872020336 2.76963804761896 | |
| 461 208.140734794865 "C13H18O2" 208.14131127096 1.88317872020336 2.76963804761896 | |
| 462 208.140734794865 "C13H18O2" 208.14131127096 1.88317872020336 2.76963804761896 | |
| 463 208.140734794865 "C13H18O2" 208.14131127096 1.88317872020336 2.76963804761896 | |
| 464 210.062734721034 "C14H8O2" 210.06306095196 0.666553839053613 1.55301424506713 | |
| 465 210.083979167979 "C11H12O4" 210.08419032416 0.118641780184784 1.00510267178895 | |
| 466 210.083979167979 "C11H12O4" 210.08419032416 0.118641780184784 1.00510267178895 | |
| 467 210.083979167979 "C11H12O4" 210.08419032416 0.118641780184784 1.00510267178895 | |
| 468 210.083979167979 "C11H12O4" 210.08419032416 0.118641780184784 1.00510267178895 | |
| 469 210.120351012317 "C12H16O3" 210.12057582946 0.183482659441714 1.06994349365897 | |
| 470 210.120351012317 "C12H16O3" 210.12057582946 0.183482659441714 1.06994349365897 | |
| 471 210.120351012317 "C12H16O3" 210.12057582946 0.183482659441714 1.06994349365897 | |
| 472 210.120352607852 "C12H16O3" 210.12057582946 0.175889227037803 1.06235006788298 | |
| 473 210.120352607852 "C12H16O3" 210.12057582946 0.175889227037803 1.06235006788298 | |
| 474 210.120352607852 "C12H16O3" 210.12057582946 0.175889227037803 1.06235006788298 | |
| 475 212.100156161221 "C11H14O4" 212.09984038796 2.3752584755475 1.48879537311363 | |
| 476 212.100156161221 "C11H14O4" 212.09984038796 2.3752584755475 1.48879537311363 | |
| 477 212.136222384055 "C12H18O3" 212.13622589326 0.869919543901935 0.0165422240933319 | |
| 478 212.136222384055 "C12H18O3" 212.13622589326 0.869919543901935 0.0165422240933319 | |
| 479 212.136222384055 "C12H18O3" 212.13622589326 0.869919543901935 0.0165422240933319 | |
| 480 212.136222384055 "C12H18O3" 212.13622589326 0.869919543901935 0.0165422240933319 | |
| 481 212.136222384055 "C12H18O3" 212.13622589326 0.869919543901935 0.0165422240933319 | |
| 482 214.151803145384 "C12H20O3" 214.15187595706 0.54646130308974 0.340000178153895 | |
| 483 214.151803145384 "C12H20O3" 214.15187595706 0.54646130308974 0.340000178153895 | |
| 484 214.151803145384 "C12H20O3" 214.15187595706 0.54646130308974 0.340000178153895 | |
| 485 216.131018714028 "C11H18O4" 216.13114051556 0.322907453110547 0.563553829924406 | |
| 486 216.131018714086 "C11H18O4" 216.13114051556 0.322907721506433 0.56355356152852 | |
| 487 218.124808268872 "C14H16O2" 218.12566120716 3.02384862922539 3.91030694547915 | |
| 488 224.078179612933 "C15H10O2" 224.07871101576 1.48504105073755 2.37150073108116 | |
| 489 224.078179612933 "C15H10O2" 224.07871101576 1.48504105073755 2.37150073108116 | |
| 490 224.078179612933 "C15H10O2" 224.07871101576 1.48504105073755 2.37150073108116 | |
| 491 224.09977999784 "C12H14O4" 224.09984038796 0.616982904674303 0.269478639108786 | |
| 492 224.09977999784 "C12H14O4" 224.09984038796 0.616982904674303 0.269478639108786 | |
| 493 224.136699374646 "C13H18O3" 224.13622589326 2.99893514051695 2.11247148530717 | |
| 494 224.17227796171 "C14H22O2" 224.17261139856 0.600950722942109 1.48741118700085 | |
| 495 224.17227796171 "C14H22O2" 224.17261139856 0.600950722942109 1.48741118700085 | |
| 496 224.17227796171 "C14H22O2" 224.17261139856 0.600950722942109 1.48741118700085 | |
| 497 226.115658150381 "C12H16O4" 226.11549045176 1.62811273857065 0.741650298542516 | |
| 498 226.115658150381 "C12H16O4" 226.11549045176 1.62811273857065 0.741650298542516 | |
| 499 226.115658150381 "C12H16O4" 226.11549045176 1.62811273857065 0.741650298542516 | |
| 500 226.115658150381 "C12H16O4" 226.11549045176 1.62811273857065 0.741650298542516 | |
| 501 226.115658150381 "C12H16O4" 226.11549045176 1.62811273857065 0.741650298542516 | |
| 502 226.151708110935 "C13H20O3" 226.15187595706 0.144277915848729 0.742183208831159 | |
| 503 226.151708110935 "C13H20O3" 226.15187595706 0.144277915848729 0.742183208831159 | |
| 504 228.131137648228 "C12H18O4" 228.13114051556 0.873892983212467 0.0125687882583594 | |
| 505 228.131137648228 "C12H18O4" 228.13114051556 0.873892983212467 0.0125687882583594 | |
| 506 228.131137648228 "C12H18O4" 228.13114051556 0.873892983212467 0.0125687882583594 | |
| 507 230.146484831408 "C12H20O4" 230.14679057936 0.442030447263952 1.32849105222901 | |
| 508 230.146953774896 "C12H20O4" 230.14679057936 1.59555566246757 0.709093251281706 | |
| 509 230.146953774896 "C12H20O4" 230.14679057936 1.59555566246757 0.709093251281706 | |
| 510 230.146953774896 "C12H20O4" 230.14679057936 1.59555566246757 0.709093251281706 | |
| 511 232.141187744448 "C15H18O2" 232.14131127096 0.354343562016136 0.532117748979969 | |
| 512 232.141187744448 "C15H18O2" 232.14131127096 0.354343562016136 0.532117748979969 | |
| 513 234.120588943507 "C14H16O3" 234.12057582946 0.942475905212593 0.0560140728629338 | |
| 514 235.096230632649 "C13H14O4" 235.09648538796 0.331311688249821 1.08362024461755 | |
| 515 235.132374876127 "C14H18O3" 235.13287089326 0.694587984191889 2.1095184655309 | |
| 516 235.169150288447 "C15H22O2" 235.16925639856 0.963725409593842 0.451207418094866 | |
| 517 235.169150733663 "C15H22O2" 235.16925639856 0.965618584835437 0.449314245512112 | |
| 518 235.169152124204 "C15H22O2" 235.16925639856 0.97153153031254 0.443401308494957 | |
| 519 235.205451195562 "C16H26O" 235.20564190386 0.604117168155145 0.810815150729106 | |
| 520 237.075276506845 "C12H12O5" 237.07574994646 0.582066585482719 1.99699722605087 | |
| 521 237.111528356828 "C13H16O4" 237.11213545176 1.14544072076802 2.56037056412545 | |
| 522 237.112018303045 "C13H16O4" 237.11213545176 0.920868155900198 0.494064611111535 | |
| 523 237.112019670828 "C13H16O4" 237.11213545176 0.926636671114497 0.488296104167997 | |
| 524 237.112020584482 "C13H16O4" 237.11213545176 0.930489933491012 0.484442847185457 | |
| 525 237.148278581511 "C14H20O3" 237.14852095706 0.392890861985801 1.02204115806716 | |
| 526 237.148279500834 "C14H20O3" 237.14852095706 0.396767438105382 1.01816458734073 | |
| 527 237.148279949358 "C14H20O3" 237.14852095706 0.398658761918705 1.0162732662839 | |
| 528 237.148280862976 "C14H20O3" 237.14852095706 0.402511281365084 1.01242075223067 | |
| 529 237.184549014468 "C15H24O2" 237.18490646236 0.0921118308148379 1.50704316453219 | |
| 530 239.09096963952 "C12H14O5" 239.09140001026 0.385095095760414 1.80002601504209 | |
| 531 239.091465239598 "C12H14O5" 239.09140001026 1.6877556181587 0.272821766021986 | |
| 532 239.091466660302 "C12H14O5" 239.09140001026 1.69369772236327 0.278763861786514 | |
| 533 239.127684826415 "C13H18O4" 239.12778551556 0.993864508206915 0.421068362186777 | |
| 534 239.16391307677 "C14H22O3" 239.16417102086 0.336408811320849 1.07852312872874 | |
| 535 239.200148633619 "C15H26O2" 239.20055652616 0.290301354665548 1.7052324080232 | |
| 536 239.200149558732 "C15H26O2" 239.20055652616 0.286433828935788 1.70136488775915 | |
| 537 241.143534662207 "C13H20O4" 241.14343557936 1.82582164552564 0.41088759798518 | |
| 538 241.179216290616 "C14H24O3" 241.17982108466 1.09271786642804 2.50764778443825 | |
| 539 241.179719354861 "C14H24O3" 241.17982108466 0.993132245376036 0.421800623931215 | |
| 540 241.179719830955 "C14H24O3" 241.17982108466 0.995106269138665 0.419826602996853 | |
| 541 241.21591176674 "C15H28O2" 241.21620658996 0.192695369798609 1.22223636699417 | |
| 542 243.159055063238 "C13H22O4" 243.15908564316 1.28917232010034 0.125760968153109 | |
| 543 245.153563564879 "C16H20O2" 245.15360633476 1.24047165753684 0.174461561709678 | |
| 544 247.132563190861 "C15H18O3" 247.13287089326 0.169842785664374 1.24508891871248 | |
| 545 247.1330845 "C15H18O3" 247.13287089326 2.27927434265488 0.864339653532933 | |
| 546 247.169061870882 "C16H22O2" 247.16925639856 0.627910208879589 0.787022143665835 | |
| 547 249.111879997877 "C14H16O4" 249.11213545176 0.389474614118951 1.02545740108761 | |
| 548 249.111880458264 "C14H16O4" 249.11213545176 0.391322728289341 1.02360928954133 | |
| 549 249.111880929162 "C14H16O4" 249.11213545176 0.393213036202746 1.02171898425204 | |
| 550 249.111881421301 "C14H16O4" 249.11213545176 0.395188611251736 1.01974341205535 | |
| 551 249.148289361848 "C15H20O3" 249.14852095706 0.485385344386769 0.929546806500677 | |
| 552 249.14828983264 "C15H20O3" 249.14852095706 0.487274950853654 0.927657202657526 | |
| 553 249.148290324881 "C15H20O3" 249.14852095706 0.48925064680731 0.925681509555753 | |
| 554 249.148816119305 "C15H20O3" 249.14852095706 2.59961905654074 1.18468391414082 | |
| 555 249.184706718958 "C16H24O2" 249.18490646236 0.613345250152482 0.801587081771596 | |
| 556 249.184708192318 "C16H24O2" 249.18490646236 0.619257976212125 0.795674364152298 | |
| 557 249.184709150717 "C16H24O2" 249.18490646236 0.623104117411847 0.791828228313335 | |
| 558 251.09104322386 "C13H14O5" 251.09140001026 0.00601087855519502 1.42094233410668 | |
| 559 251.127353385822 "C14H18O4" 251.12778551556 0.30582534410588 1.72075637548549 | |
| 560 251.1273553 "C14H18O4" 251.12778551556 0.298203006751855 1.71313404888321 | |
| 561 251.163670915028 "C15H22O3" 251.16417102086 0.576220517323404 1.99115116607055 | |
| 562 251.16367185425 "C15H22O3" 251.16417102086 0.572481037592475 1.98741169165813 | |
| 563 251.163671854453 "C15H22O3" 251.16417102086 0.572480229291396 1.98741088335705 | |
| 564 251.19999822998 "C16H26O2" 251.20055652616 0.807581394791001 2.22251171623055 | |
| 565 251.200533002989 "C16H26O2" 251.20055652616 1.32129034448569 0.0936429891731829 | |
| 566 253.106314880516 "C13H16O5" 253.10705007406 1.4897449456884 2.90467430193439 | |
| 567 253.143063541297 "C14H20O4" 253.14343557936 0.0547415761771578 1.46967296278406 | |
| 568 253.179819702577 "C15H24O3" 253.17982108466 1.40947455960121 0.00545889876786833 | |
| 569 255.158526297006 "C14H22O4" 255.15908564316 0.777216360867221 2.19214672523214 | |
| 570 255.159072759181 "C14H22O4" 255.15908564316 1.36443948813406 0.0504939065466378 | |
| 571 255.159073713115 "C14H22O4" 255.15908564316 1.36817807877607 0.0467553212512688 | |
| 572 255.231286497577 "C16H30O2" 255.23185665376 0.818945161700135 2.23387546704844 | |
| 573 257.174356613731 "C14H24O4" 257.17473570696 0.0591373221723937 1.47406870263639 | |
| 574 257.1892988 "C18H24O" 257.18999184006 1.27973219959846 2.69466185289266 | |
| 575 259.205236189027 "C18H26O" 259.20564190386 0.150292522230509 1.56522377373226 | |
| 576 261.148641982929 "C16H20O3" 261.14852095706 1.87837105257089 0.463436930744253 | |
| 577 263.127158569519 "C15H18O4" 263.12778551556 0.967737473861687 2.38266756878954 | |
| 578 263.1271586 "C15H18O4" 263.12778551556 0.967621632899069 2.38255172782692 | |
| 579 263.127731809573 "C15H18O4" 263.12778551556 1.21082707383222 0.204106103407518 | |
| 580 263.127733321539 "C15H18O4" 263.12778551556 1.21657321024924 0.198359975199629 | |
| 581 236.136126311307 "C14H18O3" 236.13622589326 0.993218866833058 0.421714002601011 | |
| 582 236.172650875728 "C15H22O2" 236.17261139856 1.58208758115302 0.167153878548183 | |
| 583 236.172650875728 "C15H22O2" 236.17261139856 1.58208758115302 0.167153878548183 | |
| 584 236.172650875728 "C15H22O2" 236.17261139856 1.58208758115302 0.167153878548183 | |
| 585 238.115175445505 "C13H16O4" 238.11549045176 0.0920178502639935 1.32291374406528 | |
| 586 238.115175445505 "C13H16O4" 238.11549045176 0.0920178502639935 1.32291374406528 | |
| 587 238.115175445505 "C13H16O4" 238.11549045176 0.0920178502639935 1.32291374406528 | |
| 588 238.115175445505 "C13H16O4" 238.11549045176 0.0920178502639935 1.32291374406528 | |
| 589 238.151171996838 "C14H20O3" 238.15187595706 1.54100049492646 2.95592977865229 | |
| 590 238.151171996838 "C14H20O3" 238.15187595706 1.54100049492646 2.95592977865229 | |
| 591 238.151171996838 "C14H20O3" 238.15187595706 1.54100049492646 2.95592977865229 | |
| 592 238.151171996838 "C14H20O3" 238.15187595706 1.54100049492646 2.95592977865229 | |
| 593 238.187671383933 "C15H24O2" 238.18826146236 1.06243153196869 2.47736149284872 | |
| 594 240.131188700827 "C13H18O4" 240.13114051556 1.61559605037606 0.20066230025666 | |
| 595 240.167145765471 "C14H22O3" 240.16752602086 0.168361050590829 1.58329227651358 | |
| 596 242.1471261 "C13H20O4" 242.14679057936 2.80054388022674 1.38560845352832 | |
| 597 242.182525450987 "C14H24O3" 242.18317608466 1.27160572350397 2.68653538836602 | |
| 598 242.182525450987 "C14H24O3" 242.18317608466 1.27160572350397 2.68653538836602 | |
| 599 242.182525450987 "C14H24O3" 242.18317608466 1.27160572350397 2.68653538836602 | |
| 600 244.1624692 "C13H22O4" 244.16244064316 1.53189199721785 0.116958365577935 | |
| 601 250.11524500073 "C14H16O4" 250.11549045176 0.433581304166121 0.981350773411203 | |
| 602 250.11524500073 "C14H16O4" 250.11549045176 0.433581304166121 0.981350773411203 | |
| 603 250.11524500073 "C14H16O4" 250.11549045176 0.433581304166121 0.981350773411203 | |
| 604 250.11524500073 "C14H16O4" 250.11549045176 0.433581304166121 0.981350773411203 | |
| 605 250.187982175617 "C16H24O2" 250.18826146236 0.298625544564825 1.11630634212076 | |
| 606 250.187982175617 "C16H24O2" 250.18826146236 0.298625544564825 1.11630634212076 | |
| 607 250.187982175617 "C16H24O2" 250.18826146236 0.298625544564825 1.11630634212076 | |
| 608 252.130576939025 "C14H18O4" 252.13114051556 0.820321295671183 2.2352515990223 | |
| 609 252.130576939025 "C14H18O4" 252.13114051556 0.820321295671183 2.2352515990223 | |
| 610 252.167111845647 "C15H22O3" 252.16752602086 0.227529405874148 1.64246054807667 | |
| 611 252.167111845647 "C15H22O3" 252.16752602086 0.227529405874148 1.64246054807667 | |
| 612 252.167111845647 "C15H22O3" 252.16752602086 0.227529405874148 1.64246054807667 | |
| 613 252.203655640725 "C16H26O2" 252.20391152616 0.400334622217215 1.01459740829246 | |
| 614 252.203655640725 "C16H26O2" 252.20391152616 0.400334622217215 1.01459740829246 | |
| 615 254.1464384 "C14H20O4" 254.14679057936 0.0291994282985264 1.38573207708093 | |
| 616 256.1623665573 "C14H22O4" 256.16244064316 1.12571868237406 0.289214374477383 | |
| 617 256.1623665573 "C14H22O4" 256.16244064316 1.12571868237406 0.289214374477383 | |
| 618 256.1623665573 "C14H22O4" 256.16244064316 1.12571868237406 0.289214374477383 | |
| 619 258.177350348509 "C14H24O4" 258.17809070696 1.45269754219207 2.86762695083233 | |
| 620 265.1427276 "C15H20O4" 265.14343557936 0.998382277249119 2.6701749506585 | |
| 621 265.1427297 "C15H20O4" 265.14343557936 0.990462022549474 2.66225470925088 | |
| 622 265.179232828615 "C16H24O3" 265.17982108466 0.546535411376705 2.21832884030001 | |
| 623 265.179233850107 "C16H24O3" 265.17982108466 0.5426833321209 2.21447676747494 | |
| 624 265.252841444825 "C18H32O" 265.25259209526 2.61184443302247 0.940045723955873 | |
| 625 267.12236751965 "C14H18O5" 267.12270013786 0.426606197444182 1.24518885824288 | |
| 626 267.12236904666 "C14H18O5" 267.12270013786 0.432322718565381 1.23947234669763 | |
| 627 267.122369547836 "C14H18O5" 267.12270013786 0.434198923125232 1.23759614532976 | |
| 628 267.122418171045 "C14H18O5" 267.12270013786 0.616224974344789 1.05557039841264 | |
| 629 267.158694267095 "C15H22O4" 267.15908564316 0.206839588287928 1.46495509994922 | |
| 630 269.174623642775 "C15H24O4" 269.17473570696 1.25547139244278 0.416325048997421 | |
| 631 269.190034324818 "C19H24O" 269.18999184006 1.82962183499682 0.157824433670973 | |
| 632 273.22099917518 "C19H28O" 273.22129196766 0.600164076237146 1.07163126971572 | |
| 633 275.200046063441 "C18H26O2" 275.20055652616 0.183081278827829 1.8548753152189 | |
| 634 277.215548404996 "C18H28O2" 277.21620658996 0.702472651690897 2.37426581972913 | |
| 635 279.122437941579 "C15H18O5" 279.12270013786 0.732437066702734 0.939358500396356 | |
| 636 279.122437941754 "C15H18O5" 279.12270013786 0.732437693741977 0.939357873357113 | |
| 637 279.23135454172 "C18H30O2" 279.23185665376 0.126396254553331 1.79819038567926 | |
| 638 279.231355640483 "C18H30O2" 279.23185665376 0.122461299271082 1.79425543711485 | |
| 639 281.13761021831 "C15H20O5" 281.13835020166 0.960304056142152 2.63209679316573 | |
| 640 281.137610738539 "C15H20O5" 281.13835020166 0.958453615084006 2.63024635534263 | |
| 641 281.138243293062 "C15H20O5" 281.13835020166 1.29152608336664 0.380270418236245 | |
| 642 281.174303000536 "C16H24O4" 281.17473570696 0.132871009079202 1.53892355560869 | |
| 643 283.190032092455 "C16H26O4" 283.19038577076 0.422888579725451 1.24890646980384 | |
| 644 283.190033711306 "C16H26O4" 283.19038577076 0.428605065011239 1.24318999395213 | |
| 645 283.190034825775 "C16H26O4" 283.19038577076 0.432540477131393 1.2392545884559 | |
| 646 283.262312527003 "C18H34O2" 283.26315678136 1.3086673113547 2.98045946597623 | |
| 647 287.200184358761 "C19H26O2" 287.20055652616 0.375949992525095 1.2958449785359 | |
| 648 289.179529598855 "C18H24O3" 289.17982108466 0.663821231031105 1.0079742212214 | |
| 649 291.231420762583 "C19H30O2" 291.23185665376 0.175079330688238 1.4967153044789 | |
| 650 266.14610143058 "C15H20O4" 266.14679057936 0.917563157300656 2.58935596592176 | |
| 651 266.14610143058 "C15H20O4" 266.14679057936 0.917563157300656 2.58935596592176 | |
| 652 266.182811998121 "C16H24O3" 266.18317608466 0.303990377331071 1.36780447335256 | |
| 653 266.182811998121 "C16H24O3" 266.18317608466 0.303990377331071 1.36780447335256 | |
| 654 278.21853290475 "C18H28O2" 278.21956158996 2.02559539609604 3.69738635232981 | |
| 655 284.194143062649 "C16H26O4" 284.19374077076 3.08735456836633 1.41555506444424 | |
| 656 284.194143062649 "C16H26O4" 284.19374077076 3.08735456836633 1.41555506444424 | |
| 657 284.194143062649 "C16H26O4" 284.19374077076 3.08735456836633 1.41555506444424 | |
| 658 299.236443896427 "C21H30O" 299.23694203146 0.651756068302325 1.66468427872214 | |
| 659 303.194973778509 "C19H26O3" 303.19547114846 0.62749848102663 1.64042671588087 | |
| 660 303.194974339572 "C19H26O3" 303.19547114846 0.625647979815064 1.63857621654412 | |
| 661 303.194974912944 "C19H26O3" 303.19547114846 0.623756880884793 1.63668511967614 | |
| 662 303.194976080426 "C19H26O3" 303.19547114846 0.619906285233851 1.6328345279623 | |
| 663 307.189946735382 "C18H26O4" 307.19038577076 0.416267900630724 1.42919634952033 | |
| 664 307.189947923199 "C18H26O4" 307.19038577076 0.41240118405448 1.42532963682999 | |
| 665 307.18994792349 "C18H26O4" 307.19038577076 0.412400236634515 1.42532868941003 | |
| 666 319.189936569937 "C19H26O4" 319.19038577076 0.394384665565221 1.40731313659619 | |
| 667 321.205872158847 "C19H28O4" 321.20603583456 0.503363261639355 0.509566118743638 | |
| 668 321.205872765715 "C19H28O4" 321.20603583456 0.505252605459811 0.507676776869838 | |
| 669 323.184827444901 "C18H26O5" 323.18530039306 0.450467843125308 1.4633962573597 | |
| 670 323.184828083672 "C18H26O5" 323.18530039306 0.448491355572382 1.46141977191739 | |
| 671 300.2405905 "C21H30O" 300.24029703146 1.99037642915533 0.977445542485022 | |
| 672 308.1930418 "C18H26O4" 308.19374077076 1.25503137428853 2.26795897354048 | |
| 673 308.1930418 "C18H26O4" 308.19374077076 1.25503137428853 2.26795897354048 | |
| 674 308.1930418 "C18H26O4" 308.19374077076 1.25503137428853 2.26795897354048 | |
| 675 320.193218960245 "C19H26O4" 320.19374077076 0.616742945498346 1.62967119125355 | |
| 676 324.188220066161 "C18H26O5" 324.18865539306 0.329891120366754 1.34281965682138 | |
| 677 324.188220066161 "C18H26O5" 324.18865539306 0.329891120366754 1.34281965682138 |