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

Submission id: KO001651

Outputs for Pimelic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001651
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: 99.0, 159.1,
Processing time: 0:00:01.479922
Queried mass list: ['58.700', '95.000', '97.200', '99.300', '115.400', '120.700', '126.400', '141.100', '158.200']

Queried mass	Num. matched formulas	Num. matched fragments
58.7 (link to fragments)	3	7
95.0 (link to fragments)	1	2
97.2 (link to fragments)	1	2
99.3 (link to fragments)	1	2
115.4 (link to fragments)	1	2
120.7	No match found!	No match found!
126.4	No match found!	No match found!
141.1 (link to fragments)	1	4
158.2 (link to fragments)	1	1