Processed databases
Atom-Mass pairs
Outputs for Paeonol; GC-EI-TOF; MS; n TMS; RT:620.077 sec
Database: Engineering department, Osaka Univ.
Entry ID: OUF00410
Synonyms: Paeonol
Total mass: 166.1735
Formula: H10 C9 O3
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: 176.0,179.0,182.0,189.0,192.0,195.0,201.0,205.0,208.0,214.0,217.0,221.0,224.0,228.0,238.0,245.0,251.0,275.0,302.0,322.0,330.0,333.0,339.0,367.0,392.0,441.0,464.0,
Replicated queried mass peaks: 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 95.0, 96.0, 99.0, 102.0, 103.0, 105.0, 106.0, 108.0, 109.0, 111.0, 112.0, 118.0, 120.0, 121.0, 123.0, 124.0, 130.0, 131.0, 134.0, 135.0, 137.0, 138.0, 148.0, 149.0, 151.0, 152.0, 162.0, 163.0, 165.0, 166.0, 169.0, 177.0, 180.0, 181.0, 183.0, 184.0, 191.0, 193.0, 194.0, 196.0, 206.0, 207.0, 209.0, 222.0, 223.0, 225.0, 226.0, 229.0, 239.0, 246.0, 324.0,
Processing time: 0:00:01.828382
Queried mass list: ['85.000', '88.000', '91.000', '94.000', '97.000', '101.000', '104.000', '107.000', '110.000', '113.000', '116.000', '119.000', '122.000', '125.000', '129.000', '133.000', '136.000', '139.000', '147.000', '150.000', '153.000', '161.000', '164.000', '167.000']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 85.0 (link to fragments) | 2 | 3 |
| 88.0 | No match found! | No match found! |
| 91.0 (link to fragments) | 1 | 3 |
| 94.0 (link to fragments) | 1 | 3 |
| 97.0 (link to fragments) | 1 | 3 |
| 101.0 | No match found! | No match found! |
| 104.0 (link to fragments) | 1 | 3 |
| 107.0 (link to fragments) | 1 | 3 |
| 110.0 (link to fragments) | 1 | 3 |
| 113.0 (link to fragments) | 1 | 1 |
| 116.0 (link to fragments) | 1 | 3 |
| 119.0 (link to fragments) | 1 | 3 |
| 122.0 (link to fragments) | 1 | 3 |
| 125.0 (link to fragments) | 1 | 3 |
| 129.0 (link to fragments) | 1 | 2 |
| 133.0 (link to fragments) | 2 | 3 |
| 136.0 (link to fragments) | 2 | 3 |
| 139.0 (link to fragments) | 3 | 4 |
| 147.0 (link to fragments) | 2 | 7 |
| 150.0 (link to fragments) | 2 | 7 |
| 153.0 (link to fragments) | 1 | 5 |
| 161.0 (link to fragments) | 1 | 1 |
| 164.0 (link to fragments) | 1 | 1 |
| 167.0 (link to fragments) | 1 | 1 |