NMRFAM Logo Computational Annotation of MS Peaks (CAMP)
Home
Processed databases
Atom-Mass pairs

Search:
(Search for compound name or MassBank ID)

Submission id: KO001942

Outputs for Thiamine monophosphate; LC-ESI-QQ; MS2; CE:50 V; [M-2H]-


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001942
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: 80.3, 97.1,
Processing time: 0:00:03.766833

Results for the quried mass "173.6"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C6O3N1P1 0.494 8 0 C3,C4,C6,C8,C10,C11,N16,O17,O18,O20,P21
C6O3N1P1 0.494 8 1 C3,C4,C6,C8,C10,C11,N16,O17,O19,O20,P21
C6O3N1P1 0.494 8 1 C3,C4,C6,C8,C10,C11,N16,O18,O19,O20,P21
C9O1N3 0.429 7 0 C3,C4,C5,C6,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.429 7 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,N14,N15,N16,O20
C9O1N3 0.429 7 0 C3,C4,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.429 7 0 C3,C4,C5,C6,C8,C9,C10,C11,C12,N13,N14,N16,O20
C9O1N3 0.429 7 0 C3,C4,C5,C6,C8,C9,C10,C11,C12,N13,N15,N16,O20
C9O1N3 0.429 7 0 C1,C3,C4,C5,C6,C8,C9,C10,C11,N14,N15,N16,O20
C9O1N3 0.429 7 0 C1,C3,C4,C6,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.429 7 0 C2,C3,C4,C6,C8,C9,C10,C11,C12,N13,N15,N16,O20
C9O1N3 0.429 7 0 C2,C3,C4,C6,C8,C9,C10,C11,C12,N14,N15,N16,O20
C9O1N3 0.429 7 0 C2,C3,C4,C5,C6,C8,C9,C10,C11,N14,N15,N16,O20
C8O2N1P1 0.473 1 0 C3,C4,C5,C6,C7,C8,C10,C11,N16,O17,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C5,C6,C8,C10,C11,C12,N16,O17,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C5,C6,C7,C8,C10,C11,N16,O18,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C5,C6,C8,C10,C11,C12,N16,O18,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C5,C6,C7,C8,C10,C11,N16,O19,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C5,C6,C8,C10,C11,C12,N16,O19,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C6,C7,C8,C10,C11,C12,N16,O17,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C6,C7,C8,C10,C11,C12,N16,O18,O20,P21
C8O2N1P1 0.473 1 0 C3,C4,C6,C7,C8,C10,C11,C12,N16,O19,O20,P21
C8O2N1P1 0.473 1 0 C1,C3,C4,C6,C8,C10,C11,C12,N16,O17,O20,P21
C8O2N1P1 0.473 1 0 C1,C3,C4,C6,C8,C10,C11,C12,N16,O18,O20,P21
C8O2N1P1 0.473 1 0 C1,C3,C4,C6,C8,C10,C11,C12,N16,O19,O20,P21
C7N4S1 0.425 1 0 C2,C5,C6,C7,C9,C10,C12,N13,N14,N15,N16,S22
C4O3N1P1S1 0.494 1 0 C3,C4,C7,C11,N16,O17,O18,O20,P21,S22
C4O3N1P1S1 0.494 1 0 C3,C4,C7,C11,N16,O17,O19,O20,P21,S22
C4O3N1P1S1 0.494 1 0 C3,C4,C7,C11,N16,O18,O19,O20,P21,S22
C8N3S1 0.406 3 0 C3,C5,C6,C7,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C5,C6,C7,C9,C10,C11,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C6,C7,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C5,C6,C7,C8,C9,C10,C11,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C5,C6,C7,C9,C10,C11,C12,N13,N14,N16,S22
C8N3S1 0.406 3 0 C3,C5,C6,C7,C8,C10,C11,C12,N13,N14,N16,S22
C8N3S1 0.406 3 0 C3,C5,C6,C7,C8,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C5,C6,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C6,C7,C8,C9,C10,C11,C12,N13,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C5,C6,C8,C9,C10,C11,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C6,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C5,C6,C7,C10,C11,C12,N13,N14,N16,S22
C8N3S1 0.406 3 0 C3,C4,C5,C6,C7,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C6,C7,C9,C10,C11,C12,N13,N15,N16,S22
C8N3S1 0.406 3 0 C3,C4,C6,C7,C8,C10,C11,C12,N13,N15,N16,S22
C8N3S1 0.406 3 0 C5,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C5,C6,C7,C8,C9,C10,C11,C12,N13,N14,N16,S22
C8N3S1 0.406 3 0 C5,C6,C7,C8,C9,C10,C11,C12,N13,N15,N16,S22
C8N3S1 0.406 3 0 C1,C5,C6,C7,C8,C9,C10,C11,N14,N15,N16,S22
C8N3S1 0.406 3 0 C1,C6,C7,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C1,C5,C6,C7,C8,C10,C11,C12,N13,N14,N16,S22
C8N3S1 0.406 3 0 C1,C5,C6,C7,C8,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C1,C6,C7,C8,C9,C10,C11,C12,N13,N15,N16,S22
C8N3S1 0.406 3 0 C1,C5,C6,C7,C8,C9,C10,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C1,C5,C6,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C2,C5,C6,C7,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C2,C5,C6,C8,C9,C10,C11,C12,N14,N15,N16,S22
C8N3S1 0.406 3 0 C2,C5,C6,C7,C9,C10,C11,C12,N13,N14,N16,S22
C8N3S1 0.406 3 0 C2,C5,C6,C8,C9,C10,C11,C12,N13,N14,N16,S22
C6O1N1P1S1 0.428 8 1 C3,C4,C6,C7,C10,C11,N16,O20,P21,S22
C6O1N1P1S1 0.428 8 1 C3,C4,C6,C7,C8,C11,N16,O20,P21,S22
C6O1N1P1S1 0.428 8 0 C1,C3,C4,C7,C8,C11,N16,O20,P21,S22
C9O1N1P1 0.492 4 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N16,O20,P21
C5O2N1P1S1 0.471 4 0 C3,C4,C6,C7,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C7,C8,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C6,C7,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C7,C8,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C6,C7,C11,N16,O19,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C7,C8,C11,N16,O19,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C6,C8,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C6,C8,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C3,C4,C6,C8,C11,N16,O19,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C1,C3,C4,C8,C11,N16,O17,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C1,C3,C4,C8,C11,N16,O18,O20,P21,S22
C5O2N1P1S1 0.471 4 0 C1,C3,C4,C8,C11,N16,O19,O20,P21,S22
C8O1N2P1 0.496 3 0 C3,C4,C5,C6,C8,C9,C10,C11,N14,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C6,C8,C9,C10,C11,C12,N15,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C5,C6,C8,C10,C11,C12,N13,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C5,C6,C8,C10,C11,C12,N15,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C5,C6,C7,C8,C10,C11,N14,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C5,C6,C8,C10,C11,C12,N14,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C6,C7,C8,C10,C11,C12,N13,N16,O20,P21
C8O1N2P1 0.496 3 0 C3,C4,C6,C7,C8,C10,C11,C12,N15,N16,O20,P21
C8O1N2P1 0.496 3 0 C1,C3,C4,C5,C6,C8,C10,C11,N14,N16,O20,P21
C8O1N2P1 0.496 3 0 C1,C3,C4,C6,C8,C10,C11,C12,N13,N16,O20,P21
C8O1N2P1 0.496 3 0 C1,C3,C4,C6,C8,C10,C11,C12,N15,N16,O20,P21
C8O1N4 0.449 5 0 C3,C4,C5,C6,C8,C10,C11,C12,N13,N14,N15,N16,O20
C8O1N4 0.449 5 0 C3,C4,C6,C8,C9,C10,C11,C12,N13,N14,N15,N16,O20
C9O1N1S1 0.409 3 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N16,O20,S22
C9O1N1S1 0.409 3 0 C1,C3,C4,C6,C7,C8,C10,C11,C12,N16,O20,S22
C10O1N2 0.409 9 0 C2,C3,C4,C5,C6,C8,C9,C10,C11,C12,N14,N16,O20
C7O1N3S1 0.449 1 0 C3,C4,C6,C7,C10,C11,C12,N13,N15,N16,O20,S22
C9N2S1 0.386 5 0 C3,C5,C6,C7,C8,C9,C10,C11,C12,N14,N16,S22
C9N2S1 0.386 5 0 C3,C5,C6,C7,C8,C9,C10,C11,C12,N15,N16,S22
C9N2S1 0.386 5 0 C3,C4,C5,C6,C7,C8,C9,C10,C11,N14,N16,S22
C9N2S1 0.386 5 0 C3,C4,C6,C7,C8,C9,C10,C11,C12,N15,N16,S22
C9N2S1 0.386 5 0 C3,C4,C5,C6,C7,C9,C10,C11,C12,N14,N16,S22
C9N2S1 0.386 5 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N14,N16,S22
C9N2S1 0.386 5 0 C3,C4,C5,C6,C7,C9,C10,C11,C12,N15,N16,S22
C9N2S1 0.386 5 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N13,N16,S22
C9N2S1 0.386 5 0 C3,C4,C5,C6,C7,C8,C10,C11,C12,N15,N16,S22
C9N2S1 0.386 5 0 C1,C5,C6,C7,C8,C9,C10,C11,C12,N14,N16,S22
C7O2N2P1 0.453 1 0 C3,C4,C5,C6,C8,C10,C11,N14,N16,O17,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C6,C8,C10,C11,C12,N13,N16,O17,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C6,C8,C10,C11,C12,N15,N16,O17,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C5,C6,C8,C10,C11,N14,N16,O18,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C6,C8,C10,C11,C12,N13,N16,O18,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C6,C8,C10,C11,C12,N15,N16,O18,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C5,C6,C8,C10,C11,N14,N16,O19,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C6,C8,C10,C11,C12,N13,N16,O19,O20,P21
C7O2N2P1 0.453 1 0 C3,C4,C6,C8,C10,C11,C12,N15,N16,O19,O20,P21
C8O1N2S1 0.429 1 0 C3,C4,C5,C6,C7,C9,C10,C11,N14,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C6,C7,C9,C10,C11,C12,N15,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C5,C6,C7,C8,C10,C11,N14,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C6,C7,C8,C10,C11,C12,N13,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C6,C7,C8,C10,C11,C12,N15,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C5,C6,C8,C9,C10,C11,N14,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C6,C8,C9,C10,C11,C12,N15,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C5,C6,C7,C10,C11,C12,N13,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C5,C6,C7,C10,C11,C12,N15,N16,O20,S22
C8O1N2S1 0.429 1 0 C3,C4,C5,C6,C7,C10,C11,C12,N14,N16,O20,S22
C9N4 0.406 9 0 C1,C2,C5,C6,C7,C8,C9,C10,C12,N13,N14,N15,N16
C7O1N3P1 0.476 1 0 C3,C4,C6,C8,C10,C11,C12,N13,N15,N16,O20,P21
Flag Counter