4-Pyridoxic acid; LC-ESI-QQ; MS2; CE:20 V; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Submission id: KO003834

Outputs for 4-Pyridoxic acid; LC-ESI-QQ; MS2; CE:20 V; [M+H]+

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003834
Synonyms: 4-Pyridoxate, 4-Pyridoxic acid
Total mass: 183.161
Formula: H9 C8 O4 N1

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: 83.0, 85.0, 92.3, 94.9, 103.7, 105.8, 106.7, 110.1, 111.0, 120.8, 123.4, 124.0, 136.0, 149.1, 166.3, 184.2,
Processing time: 0:00:03.084151

Results for the quried mass "117.1"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C6O2N1	0.038	1	0	C1,C2,C3,C4,C5,C7,N9,O10,O11