ID	Query(Da)	Delta(ppm)	Metabolite_Name	Cpd_MW(Da)	Formula	Adduct	Adduct_MW(Da)	HMDB_ID
mz_00001	175.01	78	[DL-Isocitric acid lactone]	174.016437913	C6H6O6	[M+H]	175.023714	HMDB0341313
mz_00001	175.01	38	[Pyridin-3-yl sulfate]	173.986652367	C5H4NO4S	[M+NH4-H2O]	175.016628	HMDB0304907
mz_00001	175.01	271	[Trinitrosotrimethylenetriamine]	174.050138077	C3H6N6O3	[M+H]	175.057414	HMDB0259249
mz_00001	175.01	211	[Semidehydroascorbic acid]	175.024262945	C6H7O6	[M+NH4-H2O]	175.046963	HMDB0258226
mz_00001	175.01	166	["Naphthalene-1,2,4-trione"]	174.031694053	C10H6O3	[M+H]	175.03897	HMDB0257698
mz_00002	238.19	41	["N,N-di-n-propyldopamine"]	237.172878985	C14H23NO2	[M+H]	238.180155	HMDB0255249
mz_00002	238.19	41	[Deacetylmoxisylyte]	237.172878985	C14H23NO2	[M+H]	238.180155	HMDB0250903
mz_00002	238.19	109	["(2E,4E)-pentadeca-2,4-dienoic acid"]	238.193280077	C15H26O2	[M+NH4-H2O]	238.21598	HMDB0340866
mz_00002	238.19	109	["(6Z,9Z)-pentadeca-6,9-dienoic acid"]	238.193280077	C15H26O2	[M+NH4-H2O]	238.21598	HMDB0340865
mz_00002	238.19	109	["(3Z,5Z)-pentadeca-3,5-dienoic acid"]	238.193280077	C15H26O2	[M+NH4-H2O]	238.21598	HMDB0340864
mz_00003	420.16	93	[Tapentadol-beta-D-glucuronide]	397.210052342	C20H31NO7	[M+Na]	420.19927	HMDB0341397
mz_00003	420.16	31	["10-Chloro-1-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-3-phenyl-6,7-dihydrobenzo[a]quinolizin-4-one"]	420.1240702	C24H21ClN2O3	[M+NH4-H2O]	420.14677	HMDB0259567
mz_00003	420.16	93	["N-Acetyl-9-aminominocycline, (4R)-"]	397.210052342	C20H31NO7	[M+Na]	420.19927	HMDB0259457
mz_00003	420.16	91	[Pglu-his-pro-gly; Gly-thyrotropin-releasing hormone]	420.175732517	C18H24N6O6	[M+NH4-H2O]	420.198433	HMDB0259129
mz_00003	420.16	22	[Reduced ketanserin]	397.180169808	C22H24FN3O3	[M+Na]	420.169388	HMDB0257133
mz_00004	780.32	53	[Vaniprevir]	757.372049545	C38H55N5O9S	[M+Na]	780.361268	HMDB0259762
mz_00004	780.32	12	[Ravtansine]	779.3218438	C38H54ClN3O10S	[M+H]	780.32912	HMDB0247402
mz_00004	780.32	37	[2-Hydroxypropyl starch]	780.326323443	C31H56O22	[M+NH4-H2O]	780.349023	HMDB0303342
mz_00004	780.32	63	["N,N'-Diacetylchitobiosyldiphosphodolichol"]	780.248300452	C28H50N2O19P2	[M+NH4-H2O]	780.271	HMDB0001196
mz_00004	780.32	55	[3'-Sialyl-3-fucosyllactose]	779.269536879	C29H49NO23	[M+H]	780.276813	HMDB0006606
mz_00005	956.25	10	[undec-10-enoyl-CoA]	933.250975475	C32H54N7O17P3S	[M+Na]	956.240193	HMDB0300959
mz_00005	956.25	10	[Undec-8-enoyl-CoA]	933.250975475	C32H54N7O17P3S	[M+Na]	956.240193	HMDB0300958
mz_00005	956.25	10	[Undec-9-enoyl-CoA]	933.250975475	C32H54N7O17P3S	[M+Na]	956.240193	HMDB0300957
mz_00005	956.25	10	[Undec-3-enoyl-CoA]	933.250975475	C32H54N7O17P3S	[M+Na]	956.240193	HMDB0300956
mz_00005	956.25	10	[(7E)-Undec-7-enoyl-CoA]	933.250975475	C32H54N7O17P3S	[M+Na]	956.240193	HMDB0300955
mz_00006	1100.45	0	UNKNOWN	N/A	N/A	N/A	N/A	N/A