Related entries (identical compound): GLS00133 KO001651 KO001652 KO001653 KO001654 KO001655 JP003896 OUF00263

Submission id: KO001654

Outputs for Pimelic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001654
Synonyms: Pimelate, Heptanedioic acid, 6-Carboxyhexanoate, Pimelic acid
Total mass: 160.1673
Formula: H12 C7 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: 95.3,
Processing time: 0:00:01.504012
Queried mass list: ['40.700', '54.400', '66.900', '69.000', '77.000', '80.200', '93.300', '97.200', '115.300']

Queried mass	Num. matched formulas	Num. matched fragments
40.7 (link to fragments)	2	9
54.4 (link to fragments)	3	10
66.9 (link to fragments)	3	9
69.0 (link to fragments)	3	9
77.0 (link to fragments)	2	6
80.2 (link to fragments)	3	8
93.3 (link to fragments)	1	2
97.2 (link to fragments)	1	2
115.3 (link to fragments)	1	1