Processed databases
Atom-Mass pairs
Related entries (identical compound):
PR100196
PR100602
KO001639
KO001640
KO003753
KO003757
KO003756
KO003755
KO003754
KO001638
KO001636
KO001637
JP006258
OUF00436
KZ000070
PR010229
Outputs for Pyridoxine; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001639
Synonyms: Pyridoxine, Pyridoxol
Total mass: 169.1774
Formula: H11 C8 O3 N1
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: 80.1, 93.3, 94.3, 106.9, 108.0, 120.9, 123.0, 135.8,
Processing time: 0:00:02.406821
Queried mass list: ['39.200', '50.900', '66.000', '78.700', '81.100', '89.900', '92.300', '95.800', '106.300', '120.100', '122.300', '135.100', '138.100', '149.400', '165.800']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 39.2 (link to fragments) | 3 | 13 |
| 50.9 (link to fragments) | 3 | 21 |
| 66.0 (link to fragments) | 4 | 25 |
| 78.7 (link to fragments) | 4 | 27 |
| 81.1 (link to fragments) | 4 | 14 |
| 89.9 (link to fragments) | 1 | 1 |
| 92.3 (link to fragments) | 2 | 3 |
| 95.8 (link to fragments) | 2 | 3 |
| 106.3 (link to fragments) | 2 | 3 |
| 120.1 (link to fragments) | 2 | 3 |
| 122.3 (link to fragments) | 2 | 3 |
| 135.1 (link to fragments) | 3 | 5 |
| 138.1 (link to fragments) | 3 | 5 |
| 149.4 (link to fragments) | 3 | 6 |
| 165.8 (link to fragments) | 1 | 1 |