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Submission id: KO009299

Outputs for Thiamine monophosphate; LC-ESI-IT; MS3; m/z: 345/122; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO009299
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: MS3
Instrument: LC/MSD Trap XCT, Agilent Technologies
Instrument type: LC-ESI-IT
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 382.1,388.6,
Replicated queried mass peaks: 81.1, 342.7,
Processing time: 0:00:02.246395

Results for the quried mass "167.1"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C8O1N1P1 0.044 10 2 C3,C4,C5,C6,C7,C8,C10,C11,N16,O20,P21
C8O1N1P1 0.044 10 1 C1,C3,C4,C6,C8,C10,C11,C12,N16,O20,P21
C7O1N2S1 0.108 7 0 C3,C4,C5,C6,C7,C10,C11,N14,N16,O20,S22
C7O1N2S1 0.108 7 0 C3,C4,C6,C7,C10,C11,C12,N13,N16,O20,S22
C7O1N2S1 0.108 7 0 C3,C4,C6,C7,C10,C11,C12,N15,N16,O20,S22
C7O1N2S1 0.108 7 0 C3,C4,C5,C6,C8,C10,C11,N14,N16,O20,S22
C7O1N2S1 0.108 7 0 C3,C4,C6,C8,C10,C11,C12,N15,N16,O20,S22
C6O1N1P1S1 0.025 2 0 C3,C4,C6,C7,C10,C11,N16,O20,P21,S22
C6O1N1P1S1 0.025 2 0 C3,C4,C6,C7,C8,C11,N16,O20,P21,S22
C6O1N1P1S1 0.025 2 0 C1,C3,C4,C7,C8,C11,N16,O20,P21,S22
C6O1N1P1S1 0.025 2 0 C3,C4,C6,C8,C10,C11,N16,O20,P21,S22
C10N3 0.067 5 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16
C8O1N1S1 0.128 9 1 C3,C4,C5,C6,C7,C8,C10,C11,N16,O20,S22
C8O1N1S1 0.128 9 2 C3,C4,C6,C7,C8,C10,C11,C12,N16,O20,S22
C8O1N1S1 0.128 9 1 C3,C4,C5,C6,C7,C10,C11,C12,N16,O20,S22
C8O1N1S1 0.128 9 0 C1,C3,C4,C6,C7,C8,C10,C11,N16,O20,S22
C8N2S1 0.151 11 2 C3,C4,C5,C6,C7,C10,C11,C12,N13,N16,S22
C8N2S1 0.151 11 2 C3,C4,C5,C6,C7,C10,C11,C12,N15,N16,S22
C7O1N2P1 0.025 8 1 C3,C4,C5,C6,C8,C10,C11,N14,N16,O20,P21
C7O1N2P1 0.025 8 1 C3,C4,C6,C8,C10,C11,C12,N13,N16,O20,P21
C7O1N2P1 0.025 8 1 C3,C4,C6,C8,C10,C11,C12,N15,N16,O20,P21
C6N4S1 0.111 7 1 C5,C6,C7,C9,C10,C12,N13,N14,N15,N16,S22
C6N4S1 0.111 7 1 C5,C6,C7,C10,C11,C12,N13,N14,N15,N16,S22
C6N4S1 0.111 7 2 C5,C6,C8,C10,C11,C12,N13,N14,N15,N16,S22
C6N4S1 0.111 7 2 C6,C7,C9,C10,C11,C12,N13,N14,N15,N16,S22
C6N4S1 0.111 7 0 C2,C6,C7,C9,C10,C12,N13,N14,N15,N16,S22
C9N4 0.047 3 0 C1,C2,C5,C6,C7,C8,C9,C10,C12,N13,N14,N15,N16
C9O1N3 0.024 1 0 C3,C4,C5,C6,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.024 1 0 C3,C4,C5,C6,C8,C9,C10,C11,C12,N13,N14,N16,O20
C9O1N3 0.024 1 0 C3,C4,C5,C6,C8,C9,C10,C11,C12,N13,N15,N16,O20
C9O1N3 0.024 1 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,N14,N15,N16,O20
C9O1N3 0.024 1 0 C3,C4,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.024 1 0 C1,C3,C4,C5,C6,C8,C9,C10,C11,N14,N15,N16,O20
C9O1N3 0.024 1 0 C1,C3,C4,C6,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.024 1 0 C2,C3,C4,C6,C8,C9,C10,C11,C12,N13,N15,N16,O20
C9O1N3 0.024 1 0 C2,C3,C4,C6,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.024 1 0 C2,C3,C4,C5,C6,C8,C9,C10,C11,N14,N15,N16,O20
C4O3P1S1 0.043 8 1 C3,C4,C7,C11,O17,O18,O20,P21,S22
C4O3P1S1 0.043 8 2 C3,C4,C7,C11,O17,O19,O20,P21,S22
C4O3P1S1 0.043 8 2 C3,C4,C7,C11,O18,O19,O20,P21,S22
C7N3S1 0.131 9 2 C3,C5,C6,C7,C9,C10,C11,N14,N15,N16,S22
C7N3S1 0.131 9 2 C3,C5,C6,C7,C10,C11,C12,N13,N14,N16,S22
C7N3S1 0.131 9 2 C3,C5,C6,C7,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.131 9 2 C3,C6,C7,C9,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.131 9 2 C3,C6,C7,C8,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.131 9 0 C3,C4,C6,C7,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.131 9 1 C1,C5,C6,C7,C8,C9,C10,N14,N15,N16,S22
C7N3S1 0.131 9 2 C1,C6,C7,C8,C9,C10,C12,N14,N15,N16,S22
C7N3S1 0.131 9 2 C1,C5,C6,C8,C9,C10,C11,N14,N15,N16,S22
C7N3S1 0.131 9 1 C2,C5,C6,C7,C9,C10,C12,N14,N15,N16,S22
C7N3S1 0.131 9 1 C2,C6,C7,C9,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.131 9 2 C2,C6,C8,C9,C10,C11,C12,N13,N15,N16,S22
C7N3S1 0.131 9 2 C2,C6,C7,C9,C10,C11,C12,N14,N15,N16,S22
C7N3S1 0.131 9 1 C2,C5,C6,C7,C9,C10,C11,N14,N15,N16,S22
C7N3S1 0.131 9 2 C2,C5,C6,C8,C9,C10,C11,N14,N15,N16,S22
C9O1N1P1 0.040 2 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N16,O20,P21
C5O2N1P1S1 0.018 2 0 C3,C4,C6,C7,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C7,C8,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C6,C7,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C7,C8,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C6,C7,C11,N16,O19,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C7,C8,C11,N16,O19,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C6,C8,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C6,C8,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C3,C4,C6,C8,C11,N16,O19,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C1,C3,C4,C8,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C1,C3,C4,C8,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.018 2 0 C1,C3,C4,C8,C11,N16,O19,O20,P21,S22
C8O1N4 0.004 1 0 C3,C4,C5,C6,C8,C10,C11,C12,N13,N14,N15,N16,O20
C8O1N4 0.004 1 0 C3,C4,C6,C8,C9,C10,C11,C12,N13,N14,N15,N16,O20
C3O4P1S1 0.000 4 0 C3,C4,C11,O17,O18,O19,O20,P21,S22
C7O2N1P1 0.002 6 0 C3,C4,C5,C6,C8,C10,C11,N16,O17,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C6,C8,C10,C11,C12,N16,O17,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C5,C6,C8,C10,C11,N16,O18,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C6,C8,C10,C11,C12,N16,O18,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C5,C6,C8,C10,C11,N16,O19,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C6,C8,C10,C11,C12,N16,O19,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C6,C7,C8,C10,C11,N16,O17,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C6,C7,C8,C10,C11,N16,O18,O20,P21
C7O2N1P1 0.002 6 0 C3,C4,C6,C7,C8,C10,C11,N16,O19,O20,P21
C7O2N1P1 0.002 6 0 C1,C3,C4,C6,C8,C10,C11,N16,O17,O20,P21
C7O2N1P1 0.002 6 0 C1,C3,C4,C6,C8,C10,C11,N16,O18,O20,P21
C7O2N1P1 0.002 6 0 C1,C3,C4,C6,C8,C10,C11,N16,O19,O20,P21
C10O1N2 0.044 3 0 C2,C3,C4,C5,C6,C8,C9,C10,C11,C12,N14,N16,O20
C6O3N1P1 0.041 2 0 C3,C4,C6,C8,C10,C11,N16,O17,O18,O20,P21
C6O3N1P1 0.041 2 0 C3,C4,C6,C8,C10,C11,N16,O17,O19,O20,P21
C6O3N1P1 0.041 2 0 C3,C4,C6,C8,C10,C11,N16,O18,O19,O20,P21
C9N2S1 0.067 1 0 C3,C5,C6,C7,C8,C9,C10,C11,C12,N14,N16,S22
C9N2S1 0.067 1 0 C3,C5,C6,C7,C8,C9,C10,C11,C12,N15,N16,S22
C9N2S1 0.067 1 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,N14,N16,S22
C9N2S1 0.067 1 0 C3,C4,C6,C7,C8,C9,C10,C11,C12,N15,N16,S22
C9N2S1 0.067 1 0 C3,C4,C5,C6,C7,C9,C10,C11,C12,N14,N16,S22
C9N2S1 0.067 1 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N14,N16,S22
C9N2S1 0.067 1 0 C3,C4,C5,C6,C7,C9,C10,C11,C12,N15,N16,S22
C9N2S1 0.067 1 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N13,N16,S22
C9N2S1 0.067 1 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N15,N16,S22
C9N2S1 0.067 1 0 C1,C5,C6,C7,C8,C9,C10,C11,C12,N14,N16,S22
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