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Submission id: KO001941

Outputs for Thiamine monophosphate; LC-ESI-QQ; MS2; CE:40 V; [M-2H]-


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001941
Synonyms: Thiamine monophosphate, Thiamin phosphate, Thiamine phosphate, Thiamin monophosphate, TMP
Total mass: 345.3338
Formula: C12 H18 O4 N4 P1 S1

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: 96.9, 132.3, 146.5, 147.2, 204.3, 217.6,
Processing time: 0:00:05.343694

Results for the quried mass "163.4"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C8O1N1P1 0.287 6 0 C3,C4,C5,C6,C7,C8,C10,C11,N16,O20,P21
C8O1N1P1 0.287 6 0 C3,C4,C5,C6,C8,C10,C11,C12,N16,O20,P21
C8O1N1P1 0.287 6 0 C3,C4,C6,C7,C8,C10,C11,C12,N16,O20,P21
C9N1S1 0.161 9 1 C3,C4,C5,C6,C7,C8,C10,C11,C12,N16,S22
C7O1N2S1 0.224 3 0 C3,C4,C5,C6,C7,C10,C11,N14,N16,O20,S22
C7O1N2S1 0.224 3 0 C3,C4,C6,C7,C10,C11,C12,N13,N16,O20,S22
C7O1N2S1 0.224 3 0 C3,C4,C6,C7,C10,C11,C12,N15,N16,O20,S22
C7O1N2S1 0.224 3 0 C3,C4,C5,C6,C8,C10,C11,N14,N16,O20,S22
C7O1N2S1 0.224 3 0 C3,C4,C6,C8,C10,C11,C12,N13,N16,O20,S22
C7O1N2S1 0.224 3 0 C3,C4,C6,C8,C10,C11,C12,N15,N16,O20,S22
C8N2S1 0.181 7 0 C3,C4,C6,C7,C9,C10,C11,C12,N15,N16,S22
C8N2S1 0.181 7 0 C3,C4,C5,C6,C7,C9,C10,C11,N14,N16,S22
C8N2S1 0.181 7 0 C3,C4,C5,C6,C7,C8,C10,C11,N14,N16,S22
C8N2S1 0.181 7 0 C3,C4,C5,C6,C7,C10,C11,C12,N14,N16,S22
C8N2S1 0.181 7 0 C3,C4,C5,C6,C7,C10,C11,C12,N13,N16,S22
C8N2S1 0.181 7 0 C3,C4,C5,C6,C7,C10,C11,C12,N15,N16,S22
C8N2S1 0.181 7 0 C3,C4,C5,C6,C8,C9,C10,C11,N14,N16,S22
C8N2S1 0.181 7 0 C3,C4,C6,C7,C8,C10,C11,C12,N13,N16,S22
C8N2S1 0.181 7 0 C3,C4,C6,C7,C8,C10,C11,C12,N15,N16,S22
C8N2S1 0.181 7 0 C3,C4,C6,C8,C9,C10,C11,C12,N15,N16,S22
C8N2S1 0.181 7 1 C3,C5,C6,C7,C8,C9,C10,C11,N14,N16,S22
C8N2S1 0.181 7 1 C3,C5,C6,C7,C9,C10,C11,C12,N14,N16,S22
C8N2S1 0.181 7 1 C3,C5,C6,C7,C8,C10,C11,C12,N14,N16,S22
C8N2S1 0.181 7 0 C3,C5,C6,C7,C9,C10,C11,C12,N15,N16,S22
C8N2S1 0.181 7 0 C3,C5,C6,C7,C8,C10,C11,C12,N13,N16,S22
C8N2S1 0.181 7 0 C3,C5,C6,C7,C8,C10,C11,C12,N15,N16,S22
C8N2S1 0.181 7 1 C3,C6,C7,C8,C9,C10,C11,C12,N15,N16,S22
C10N3 0.265 1 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16
C8O1N1S1 0.204 5 0 C3,C4,C5,C6,C7,C8,C10,C11,N16,O20,S22
C8O1N1S1 0.204 5 0 C3,C4,C6,C7,C8,C10,C11,C12,N16,O20,S22
C8O1N1S1 0.204 5 0 C3,C4,C5,C6,C7,C10,C11,C12,N16,O20,S22
C7O1N2P1 0.307 4 0 C3,C4,C5,C6,C8,C10,C11,N14,N16,O20,P21
C7O1N2P1 0.307 4 0 C3,C4,C6,C8,C10,C11,C12,N13,N16,O20,P21
C7O1N2P1 0.307 4 0 C3,C4,C6,C8,C10,C11,C12,N15,N16,O20,P21
C6N4S1 0.220 3 0 C5,C6,C7,C9,C10,C12,N13,N14,N15,N16,S22
C6N4S1 0.220 3 0 C5,C6,C7,C10,C11,C12,N13,N14,N15,N16,S22
C6N4S1 0.220 3 0 C5,C6,C8,C10,C11,C12,N13,N14,N15,N16,S22
C9N4 0.285 1 0 C1,C2,C5,C6,C7,C8,C9,C10,C12,N13,N14,N15,N16
C6O1N1P1S1 0.307 2 0 C3,C4,C6,C7,C10,C11,N16,O20,P21,S22
C6O1N1P1S1 0.307 2 0 C3,C4,C6,C7,C8,C11,N16,O20,P21,S22
C8N4 0.201 11 0 C1,C2,C5,C6,C8,C9,C10,C12,N13,N14,N15,N16
C7N3S1 0.201 5 0 C3,C4,C6,C7,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.201 5 0 C3,C6,C7,C9,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.201 5 0 C3,C5,C6,C7,C9,C10,C11,N14,N15,N16,S22
C7N3S1 0.201 5 0 C3,C5,C6,C7,C10,C11,C12,N13,N14,N16,S22
C7N3S1 0.201 5 0 C3,C5,C6,C7,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.201 5 0 C3,C5,C6,C8,C9,C10,C11,N14,N15,N16,S22
C7N3S1 0.201 5 0 C3,C6,C7,C9,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.201 5 0 C3,C6,C7,C8,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.201 5 0 C3,C6,C8,C9,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C9,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.201 5 1 C5,C6,C8,C9,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C8,C9,C10,C11,N14,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C8,C9,C10,C12,N14,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C9,C10,C11,C12,N13,N14,N16,S22
C7N3S1 0.201 5 1 C5,C6,C8,C9,C10,C11,C12,N13,N14,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C9,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C8,C9,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C8,C10,C11,C12,N13,N14,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C8,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.201 5 0 C5,C6,C7,C8,C10,C11,C12,N14,N15,N16,S22
C3O4P1S1 0.332 0 0 C3,C4,C11,O17,O18,O19,O20,P21,S22
C7O2N1P1 0.330 2 0 C3,C4,C5,C6,C8,C10,C11,N16,O17,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C5,C6,C8,C10,C11,N16,O18,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C5,C6,C8,C10,C11,N16,O19,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C6,C8,C10,C11,C12,N16,O17,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C6,C8,C10,C11,C12,N16,O18,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C6,C8,C10,C11,C12,N16,O19,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C6,C7,C8,C10,C11,N16,O17,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C6,C7,C8,C10,C11,N16,O18,O20,P21
C7O2N1P1 0.330 2 0 C3,C4,C6,C7,C8,C10,C11,N16,O19,O20,P21
C10O1N2 0.288 1 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,C12,N15,N16,O20
C10O1N2 0.288 1 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,C12,N14,N16,O20
C6O3N1P1 0.373 2 0 C3,C4,C6,C8,C10,C11,N16,O17,O18,O20,P21
C6O3N1P1 0.373 2 0 C3,C4,C6,C8,C10,C11,N16,O17,O19,O20,P21
C6O3N1P1 0.373 2 0 C3,C4,C6,C8,C10,C11,N16,O18,O19,O20,P21
C4O3P1S1 0.289 4 0 C3,C4,C7,C11,O17,O18,O20,P21,S22
C4O3P1S1 0.289 4 0 C3,C4,C7,C11,O17,O19,O20,P21,S22
C4O3P1S1 0.289 4 0 C3,C4,C7,C11,O18,O19,O20,P21,S22
C5O4P1 0.312 8 0 C1,C3,C4,C8,C11,O17,O18,O19,O20,P21
C8O1N3 0.224 9 1 C3,C4,C5,C6,C8,C9,C10,C11,N14,N15,N16,O20
C8O1N3 0.224 9 1 C3,C4,C5,C6,C8,C10,C11,C12,N13,N14,N16,O20
C8O1N3 0.224 9 0 C3,C4,C5,C6,C8,C10,C11,C12,N13,N15,N16,O20
C8O1N3 0.224 9 1 C3,C4,C5,C6,C8,C10,C11,C12,N14,N15,N16,O20
C4O2N1P1S1 0.266 6 0 C3,C4,C7,C11,N16,O17,O20,P21,S22
C4O2N1P1S1 0.266 6 0 C3,C4,C7,C11,N16,O18,O20,P21,S22
C4O2N1P1S1 0.266 6 1 C3,C4,C7,C11,N16,O19,O20,P21,S22
C4O2N1P1S1 0.266 6 1 C3,C4,C8,C11,N16,O17,O20,P21,S22
C4O2N1P1S1 0.266 6 1 C3,C4,C8,C11,N16,O18,O20,P21,S22
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