Processed databases
Atom-Mass pairs
Related entries (identical compound):
KO009297
KO009298
KO009299
PR100609
PR100204
KO001940
KO001941
KO001942
KO009300
KO001939
KO004195
KO004191
KO004192
KO004193
KO004194
KO001938
Outputs for Thiamine monophosphate; LC-ESI-QQ; MS2; CE:30 V; [M-2H]-
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001940
Synonyms: Thiamine monophosphate, Thiamin phosphate, Thiamine phosphate, Thiamin monophosphate, TMP
Total mass: 345.3338
Formula: C12 H18 O4 N4 P1 S1
Structure file (with ALATIS unique atom labels)
Experimental information
MS type: MS2Instrument: 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: 98.9, 132.1, 147.1, 184.7, 229.8,
Processing time: 0:00:06.262377
Queried mass list: ['59.200', '79.000', '97.000', '107.300', '112.400', '120.700', '124.200', '130.900', '138.300', '146.300', '152.700', '156.600', '160.300', '162.900', '172.700', '176.800', '184.300', '187.000', '189.100', '200.800', '204.500', '207.000', '211.200', '218.100', '222.200', '228.000', '242.900', '245.400', '260.800', '265.000', '283.600']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 59.2 (link to fragments) | 3 | 3 |
| 79.0 (link to fragments) | 7 | 49 |
| 97.0 (link to fragments) | 9 | 34 |
| 107.3 (link to fragments) | 10 | 59 |
| 112.4 (link to fragments) | 11 | 78 |
| 120.7 (link to fragments) | 12 | 76 |
| 124.2 (link to fragments) | 13 | 92 |
| 130.9 (link to fragments) | 14 | 116 |
| 138.3 (link to fragments) | 13 | 84 |
| 146.3 (link to fragments) | 18 | 107 |
| 152.7 (link to fragments) | 15 | 76 |
| 156.6 (link to fragments) | 17 | 98 |
| 160.3 (link to fragments) | 21 | 109 |
| 162.9 (link to fragments) | 22 | 98 |
| 172.7 (link to fragments) | 19 | 93 |
| 176.8 (link to fragments) | 21 | 103 |
| 184.3 (link to fragments) | 17 | 84 |
| 187.0 (link to fragments) | 17 | 97 |
| 189.1 (link to fragments) | 18 | 107 |
| 200.8 (link to fragments) | 2 | 2 |
| 204.5 (link to fragments) | 2 | 2 |
| 207.0 (link to fragments) | 3 | 3 |
| 211.2 (link to fragments) | 1 | 1 |
| 218.1 (link to fragments) | 1 | 1 |
| 222.2 | No match found! | No match found! |
| 228.0 | No match found! | No match found! |
| 242.9 | No match found! | No match found! |
| 245.4 | No match found! | No match found! |
| 260.8 | No match found! | No match found! |
| 265.0 | No match found! | No match found! |
| 283.6 | No match found! | No match found! |