Processed databases
Atom-Mass pairs
Related entries (identical compound):
JP002234
MT000008
JP003528
KO001094
KO001092
KO001093
KO001091
KO001095
BML81398
OUF00264
OUF00265
BML01204
BML81395
BML81396
BML81397
Outputs for Hippuric acid; GC-EI-TOF; MS; n TMS; RT:693.329 sec
Database: Engineering department, Osaka Univ.
Entry ID: OUF00264
Synonyms: Hippurate, Hippuric acid
Total mass: 179.1723
Formula: H9 C9 O3 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: 189.0,192.0,204.0,207.0,218.0,232.0,235.0,264.0,278.0,281.0,306.0,309.0,322.0,325.0,
Replicated queried mass peaks: 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 96.0, 100.0, 101.0, 103.0, 104.0, 106.0, 107.0, 115.0, 116.0, 118.0, 119.0, 121.0, 130.0, 131.0, 133.0, 134.0, 136.0, 137.0, 144.0, 145.0, 147.0, 148.0, 150.0, 151.0, 159.0, 160.0, 162.0, 163.0, 165.0, 175.0, 176.0, 178.0, 179.0, 190.0, 191.0, 193.0, 194.0, 205.0, 206.0, 208.0, 209.0, 219.0, 220.0, 233.0, 234.0, 236.0, 237.0, 265.0, 279.0, 280.0, 282.0, 283.0, 308.0, 310.0, 323.0, 324.0,
Processing time: 0:00:02.217670
Queried mass list: ['85.000', '88.000', '91.000', '95.000', '99.000', '102.000', '105.000', '114.000', '117.000', '120.000', '129.000', '132.000', '135.000', '143.000', '146.000', '149.000', '158.000', '161.000', '164.000', '174.000', '177.000', '180.000']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 85.0 (link to fragments) | 3 | 16 |
| 88.0 (link to fragments) | 4 | 19 |
| 91.0 (link to fragments) | 4 | 29 |
| 95.0 (link to fragments) | 3 | 19 |
| 99.0 (link to fragments) | 2 | 2 |
| 102.0 (link to fragments) | 2 | 2 |
| 105.0 (link to fragments) | 1 | 1 |
| 114.0 (link to fragments) | 2 | 2 |
| 117.0 (link to fragments) | 1 | 1 |
| 120.0 (link to fragments) | 1 | 1 |
| 129.0 (link to fragments) | 2 | 3 |
| 132.0 (link to fragments) | 1 | 1 |
| 135.0 (link to fragments) | 2 | 4 |
| 143.0 | No match found! | No match found! |
| 146.0 (link to fragments) | 1 | 4 |
| 149.0 (link to fragments) | 1 | 4 |
| 158.0 (link to fragments) | 2 | 8 |
| 161.0 (link to fragments) | 2 | 8 |
| 164.0 (link to fragments) | 2 | 8 |
| 174.0 (link to fragments) | 1 | 1 |
| 177.0 (link to fragments) | 1 | 1 |
| 180.0 (link to fragments) | 1 | 1 |