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Atom-Mass pairs
Related entries (identical compound): PR100418 PR100419 MT000123 PR100876 KO003836 KO003837 KO003834 KO003835 KO003833
Submission id: PR100419

Outputs for 4-Pyridoxic acid; LC-ESI-QTOF; MS2; CE:30 V; [M+H]+


Database: Plant Science Center, RIKEN
Entry ID: PR100419
Synonyms: 4-Pyridoxate, 4-PA, 4-Pyridoxic acid, 4-Pyridoxylic acid, 4-Pyridoxinic acid, 4-Pyridoxinsaeure, 3-Hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinecarboxylic acid, 2-Methyl-3-hydroxy-4-carboxy-5-hydroxymethylpyridine, 3-Hydroxy-5-(hydroxymethyl)-2-methylisonicotinic acid
Total mass: 183.161
Formula: H9 C8 O4 N1

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: UPLC Q-Tof Premier, Waters
Instrument type: LC-ESI-QTOF
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 122.0239,
Processing time: 0:00:01.932740
Queried mass list: ['65.040', '92.050', '110.061', '120.045', '148.040']



Queried massNum. matched formulasNum. matched fragments
65.0396 (link to fragments) 4 33
92.0497 (link to fragments) 5 34
110.0609 (link to fragments) 1 2
120.045 (link to fragments) 2 3
148.0396 (link to fragments) 2 2


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