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Atom-Mass pairs
Related entries (identical compound): KO001179 KO001178 KO001175 KO001177 KO001176 KZ000231 KZ000232 KZ000233 GLS00013 KNA00041 KNA00042 KNA00043 KO003173 KO003172 KO003176 KO003175 KO003174 KNA00321 KNA00320 KNA00322 PR030010 OUF00312 PR010061 OUF01004
Submission id: KO003176

Outputs for L-Isoleucine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003176
Synonyms: Ile, 2-Amino-3-methylvaleric acid, L-Isoleucine
Total mass: 131.1724
Formula: H13 C6 O2 N1

Structure file (with ALATIS unique atom labels)

Experimental information

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

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 42.2, 44.9, 56.2, 57.1, 69.9,
Processing time: 0:00:01.181022
Queried mass list: ['30.200', '39.000', '41.100', '44.200', '55.100', '64.200', '66.900', '69.000']



Queried massNum. matched formulasNum. matched fragments
30.2 (link to fragments) 3 3
39.0 (link to fragments) 3 8
41.1 (link to fragments) 3 7
44.2 (link to fragments) 1 1
55.1 (link to fragments) 4 8
64.2 (link to fragments) 4 9
66.9 (link to fragments) 5 10
69.0 (link to fragments) 6 11


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