Related entries (identical compound): KO001405 KO001404 KO001406 JP009188

Submission id: KO001406

Outputs for 4-Methylpentanoic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001406
Synonyms: 4-Methylpentanoate, Alpha-chloroisocaproic acid, 4-Methylpentanoic acid, Valeric acid, 4-methyl-, 4-methyl-pentanoic acid, 4-methyl valeric acid, 4MV, Pentanoic acid, 4-methyl-, HRI, Isocaproic acid
Total mass: 116.1578
Formula: H12 C6 O2

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:
Processing time: 0:00:00.736212
Queried mass list: ['58.800', '69.300', '114.800']

Queried mass	Num. matched formulas	Num. matched fragments
58.8 (link to fragments)	3	3
69.3 (link to fragments)	2	2
114.8 (link to fragments)	1	1