view test-data/input03_1mz-1pcgroup-mz-relative_int.tabular @ 0:023c380900ef draft default tip

Init repository with last massbank_ws_searchspectrum master version
author fgiacomoni
date Wed, 19 Apr 2017 11:31:58 -0400
parents
children
line wrap: on
line source

mz	mzmin	mzmax	rt	rtmin	rtmax	into	intb	maxo	sn	sample	isotopes	adduct	pcgroup
303.0485467	303.0479126	303.0501709	273.698	270.334	278.072	247182.3356	246032.8821	80132	351	1	[8][M]+		1
304.0519266	304.050354	304.0531006	273.362	270.671	278.072	39377.69332	39179.45225	12431	267	1	[8][M+1]+		1
305.0552454	305.0523376	305.0632324	274.034	271.007	278.072	6932.447143	6916.875306	2489	149	1	[8][M+2]+		1
611.1574452	611.1509399	611.159729	273.362	270.334	278.072	52749.60957	52698.08698	21130	1529	1	[6][M]+	[M+H]+ 610.147	2
503.0443595	503.0398865	503.0495605	274.034	270.671	278.744	2661.062625	2635.329938	919	62	1			1
297.0306054	297.0255432	297.038147	278.072	275.38	280.426	1108.1016	1103.392	385	384	1			3
301.0504305	301.0436401	301.0579834	277.735	274.371	281.435	486.0704762	468.779315	240	12	1		[M+H]+ 300.045 [M+H-C7H6O2]+ 422.084	3
21.1283748	21.1159668	21.1455688	78.072	76.389	79.753	34.6288	31.6012	258	43	1		[X]+ 94.055	4