Processed databases
Atom-Mass pairs
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: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 80.3, 97.1,
Processing time: 0:00:03.766833
Results for the quried mass "59.1"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C1N1S1 | 0.010 | 1 | 0 | C7,N16,S22 |
| C2S1 | 0.010 | 3 | 1 | C3,C11,S22 |
| C2S1 | 0.010 | 3 | 2 | C7,C11,S22 |
| C1O1P1 | 0.116 | 0 | 0 | C4,O20,P21 |