Related entries (identical compound): PR100707 GLS00105 KO001080 KO001076 KO001077 KO001078 KO001079 OUF00267

Submission id: KO001078

Outputs for Homogentisic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001078
Synonyms: Homogentisate, 2,5-Dihydroxyphenylacetic acid, 2,5-Dihydroxyphenylacetate, Homogentisic acid
Total mass: 168.1464
Formula: H8 C8 O4

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 80.0, 107.9, 121.9, 123.2,
Processing time: 0:00:01.848723
Queried mass list: ['67.200', '69.400', '79.000', '83.000', '94.900', '102.300', '107.100', '111.100', '121.200', '124.200', '152.400', '167.100']

Queried mass	Num. matched formulas	Num. matched fragments
67.2 (link to fragments)	2	17
69.4 (link to fragments)	2	6
79.0 (link to fragments)	3	28
83.0 (link to fragments)	3	11
94.9 (link to fragments)	2	2
102.3 (link to fragments)	1	1
107.1 (link to fragments)	2	4
111.1 (link to fragments)	2	4
121.2 (link to fragments)	2	4
124.2 (link to fragments)	2	4
152.4 (link to fragments)	2	7
167.1 (link to fragments)	1	1