Processed databases
Atom-Mass pairs
Related entries (identical compound):
JP005706
GLS00132
OUF00389
KZ000064
JP010812
PR010181
ML005101
PR100181
PR100182
KO003586
KO003584
KO003585
KO003582
KO003583
PR100401
PR100402
Outputs for Niacinamide; GC-EI-TOF; MS; 1 TMS; BP:179
Database: Kazusa DNA Research Institute
Entry ID: KZ000064
Synonyms: Nicotinamide, Niacinamide
Total mass: 122.1244
Formula: H6 C6 O1 N2
Structure file (with ALATIS unique atom labels)
Experimental information
MS type: MSInstrument: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
Instrument type: GC-EI-TOF
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks: 131.0,134.0,137.0,147.0,150.0,161.0,164.0,175.0,178.0,181.0,192.0,195.0,
Replicated queried mass peaks: 83.0, 84.0, 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 95.0, 96.0, 101.0, 102.0, 104.0, 105.0, 107.0, 108.0, 110.0, 118.0, 120.0, 121.0, 123.0, 124.0, 132.0, 133.0, 135.0, 136.0, 138.0, 148.0, 149.0, 151.0, 152.0, 162.0, 163.0, 165.0, 166.0, 176.0, 177.0, 179.0, 180.0, 193.0, 194.0,
Processing time: 0:00:00.732193
Queried mass list: ['82.000', '85.000', '88.000', '91.000', '94.000', '97.000', '100.000', '103.000', '106.000', '109.000', '116.000', '119.000', '122.000']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 82.0 (link to fragments) | 2 | 3 |
| 85.0 (link to fragments) | 1 | 1 |
| 88.0 | No match found! | No match found! |
| 91.0 (link to fragments) | 2 | 4 |
| 94.0 (link to fragments) | 2 | 4 |
| 97.0 (link to fragments) | 2 | 4 |
| 100.0 (link to fragments) | 1 | 1 |
| 103.0 (link to fragments) | 3 | 7 |
| 106.0 (link to fragments) | 3 | 7 |
| 109.0 (link to fragments) | 2 | 6 |
| 116.0 (link to fragments) | 1 | 1 |
| 119.0 (link to fragments) | 1 | 1 |
| 122.0 (link to fragments) | 1 | 1 |