Related entries (identical compound): KZ000040 KO003195 KO003194 KO003196 KO003193 KO003192 PR010171 PR100156 PR100155 PR100577 KZ000147

Submission id: KO003195

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

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003195
Synonyms: Isonicotinate, Isonicotinic acid
Total mass: 123.1092
Formula: H5 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: 79.3,
Processing time: 0:00:01.596796
Queried mass list: ['27.800', '40.900', '44.800', '53.000', '77.900', '80.000', '96.100', '123.800']

Queried mass	Num. matched formulas	Num. matched fragments
27.8 (link to fragments)	3	6
40.9 (link to fragments)	2	5
44.8 (link to fragments)	1	1
53.0 (link to fragments)	3	10
77.9 (link to fragments)	1	1
80.0 (link to fragments)	2	4
96.1 (link to fragments)	2	4
123.8 (link to fragments)	1	1