comparison test-data/variableMetadata.tsv @ 5:b8d4129dd2a6 draft

planemo upload for repository https://github.com/workflow4metabolomics/metaMS commit c7a518686137f6d62b7415715152e8d5a9953ed7
author yguitton
date Fri, 06 Sep 2019 06:09:10 -0400
parents c10824185547
children
comparison
equal deleted inserted replaced
4:c10824185547 5:b8d4129dd2a6
1 Name DB.idx RI monoMW Class Formula MW std.rt rt.sd rt 1 Name DB.idx RI Formula monoMW Class std.rt rt.sd rt
2 Glycine, 3TMS 5 1302.682 291.61 Standard NA NA 13.965 0.0267 13.973 2 Glycine, 3TMS 4 1302.682 C11H29NO2Si3 291.61 Standard 13.965 0.0267 13.973
3 Pyroglutamic acid, 2TMS 6 1650.417 NA Standard C11H23NO3Si2 273.477 19.513 0.0247 19.512 3 Pyroglutamic acid, 2TMS 5 1650.417 C11H23NO3Si2 273.477 Standard 19.513 0.0247 19.512
4 Alanine, 3TMS 7 1360.504 NA Manual C12H31NO2Si3 305.637 15.323 0.028 15.332 4 Alanine, 3TMS 6 1360.504 C12H31NO2Si3 305.637 Manual 15.323 0.028 15.332
5 Aspartic acid, 2TMS 8 1422.39 NA Manual C10H23NO4Si2 277.465 17.071 0.0359 17.09 5 Aspartic acid, 2TMS 7 1422.39 C10H23NO4Si2 277.465 Manual 17.071 0.0359 17.09
6 Tryptamine, 2TMS 9 2224.531 NA Manual C16H28N2Si2 304.578 19.044 0.036 19.068 6 Tryptamine, 2TMS 8 2224.531 C16H28N2Si2 304.578 Manual 19.044 0.036 19.068
7 Unknown 1 NA NA NA Unknown NA NA NA 0.0049 10.488 7 Unknown 1 NA NA NA NA Unknown NA 0.0049 10.488
8 Unknown 2 NA NA NA Unknown NA NA NA 0.005 11.428 8 Unknown 2 NA NA NA NA Unknown NA 0.005 11.428
9 Unknown 3 NA NA NA Unknown NA NA NA 0.0037 13.262 9 Unknown 3 NA NA NA NA Unknown NA 0.0037 13.262
10 Unknown 4 NA NA NA Unknown NA NA NA 0.0032 17.879 10 Unknown 4 NA NA NA NA Unknown NA 0.0032 17.879
11 Unknown 5 NA NA NA Unknown NA NA NA 0.0046 17.181 11 Unknown 5 NA NA NA NA Unknown NA 0.0046 17.181
12 Unknown 6 NA NA NA Unknown NA NA NA 0.004 13.327 12 Unknown 6 NA NA NA NA Unknown NA 0.004 13.327