Processed databases
Atom-Mass pairs
Related entries (identical compound):
KZ000040
KO003195
KO003194
KO003196
KO003193
KO003192
PR010171
PR100156
PR100155
PR100577
KZ000147
Outputs for Isonicotinic acid; GC-EI-TOF; MS; 1 TMS; BP:106
Database: Kazusa DNA Research Institute
Entry ID: KZ000147
Synonyms: Isonicotinic acid
Total mass: 123.1092
Formula: H5 C6 O2 N1
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: 134.0,137.0,150.0,153.0,162.0,165.0,179.0,182.0,194.0,197.0,
Replicated queried mass peaks: 83.0, 84.0, 86.0, 91.0, 92.0, 94.0, 95.0, 97.0, 106.0, 107.0, 109.0, 110.0, 120.0, 121.0, 123.0, 135.0, 136.0, 138.0, 139.0, 151.0, 152.0, 163.0, 164.0, 166.0, 167.0, 180.0, 181.0, 183.0, 195.0, 196.0,
Processing time: 0:00:00.755281
Queried mass list: ['82.000', '85.000', '90.000', '93.000', '96.000', '99.000', '105.000', '108.000', '111.000', '119.000', '122.000']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 82.0 (link to fragments) | 1 | 3 |
| 85.0 (link to fragments) | 1 | 3 |
| 90.0 | No match found! | No match found! |
| 93.0 (link to fragments) | 2 | 4 |
| 96.0 (link to fragments) | 2 | 4 |
| 99.0 (link to fragments) | 1 | 2 |
| 105.0 (link to fragments) | 3 | 7 |
| 108.0 (link to fragments) | 3 | 7 |
| 111.0 (link to fragments) | 2 | 5 |
| 119.0 (link to fragments) | 1 | 1 |
| 122.0 (link to fragments) | 1 | 1 |