ID	Query(Da)	Delta(ppm)	Metabolite_Name	Cpd_MW(Da)	Formula	Adduct	Adduct_MW(Da)	HMDB_ID
mz_00001	175.01	29	[Mercaptopurine]	152.015666838	C5H4N4S	[M+Na]	175.004885	HMDB0015167
mz_00001	175.01	50	[S-Methyl benzenecarbothioate]	152.029585568	C8H8OS	[M+Na]	175.018804	HMDB0029694
mz_00001	175.01	72	["6,8-Dihydroxypurine"]	152.033425392	C5H4N4O2	[M+Na]	175.022643	HMDB0001182
mz_00001	175.01	72	[Oxypurinol]	152.033425392	C5H4N4O2	[M+Na]	175.022643	HMDB0000786
mz_00001	175.01	72	[Xanthine]	152.033425392	C5H4N4O2	[M+Na]	175.022643	HMDB0000292
mz_00002	238.19	49	[Heptanoylcholine]	216.196354081	C12H26NO2	[M+Na]	238.178296	HMDB0013239
mz_00002	238.19	140	[Fencamfamine]	215.167399677	C15H21N	[M+Na]	238.156618	HMDB0015508
mz_00002	238.19	148	[Solamine]	215.236147943	C12H29N3	[M+Na]	238.225366	HMDB0031202
mz_00002	238.19	157	[Diethylcarbamazine N-oxide]	215.163376931	C10H21N3O2	[M+Na]	238.152595	HMDB0060817
mz_00002	238.19	204	[N-Nonanoylglycine]	215.152143543	C11H21NO3	[M+Na]	238.141362	HMDB0013279
mz_00003	420.16	43	[Simulansamide]	397.152537473	C22H23NO6	[M+Na]	420.141755	HMDB0030435
mz_00004	780.32	0	UNKNOWN	N/A	N/A	N/A	N/A	N/A
mz_00005	956.25	36	["(2S,3S,4R,5R,6R)-6-{[(2S,3R,4S,5S,6R)-2-{[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-{[(3R,4R,5R)-4,5,6-trihydroxyoxan-3-yl]oxy}oxan-4-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-4,5-dihydroxy-3-{[(2R,3R,4R,5R,6R)-5-hydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)-4-(sulfooxy)oxan-2-yl]oxy}oxane-2-carboxylic acid"]	933.2267458	C31H51NO29S	[M+Na]	956.215964	HMDB0062476
mz_00005	956.25	48	[(3S)-3-isopropenyl-6-oxoheptanoyl-CoA]	933.214589966	C31H50N7O18P3S	[M+Na]	956.203808	HMDB0062370
mz_00006	1100.45	0	UNKNOWN	N/A	N/A	N/A	N/A	N/A