Processed databases
Atom-Mass pairs
Related entries (identical compound):
KO003678
KO003679
KO003676
KO003677
KNA00366
KNA00747
KNA00746
KNA00745
KNA00744
KO001571
KO001573
KO001572
KO001575
KO001574
KNA00134
KO003680
PR100724
OUF00422
Outputs for Phosphoenolpyruvic acid; GC-EI-TOF; MS; n TMS; RT:595.606 sec
Database: Engineering department, Osaka Univ.
Entry ID: OUF00422
Synonyms: Phosphoenolpyruvic acid
Total mass: 168.0418
Formula: P1 C3 O6 H5
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: 171.0,175.0,178.0,181.0,184.0,189.0,192.0,195.0,198.0,201.0,204.0,207.0,210.0,213.0,216.0,219.0,222.0,225.0,228.0,231.0,237.0,240.0,243.0,246.0,251.0,254.0,257.0,265.0,268.0,271.0,281.0,284.0,287.0,294.0,297.0,300.0,303.0,311.0,314.0,317.0,325.0,328.0,368.0,371.0,383.0,386.0,
Replicated queried mass peaks: 86.0, 87.0, 89.0, 90.0, 92.0, 93.0, 95.0, 96.0, 98.0, 99.0, 101.0, 102.0, 104.0, 105.0, 107.0, 108.0, 111.0, 115.0, 117.0, 118.0, 120.0, 121.0, 123.0, 124.0, 127.0, 129.0, 130.0, 132.0, 133.0, 135.0, 136.0, 138.0, 139.0, 142.0, 143.0, 145.0, 146.0, 148.0, 149.0, 151.0, 152.0, 155.0, 158.0, 159.0, 162.0, 163.0, 165.0, 166.0, 168.0, 169.0, 173.0, 176.0, 177.0, 179.0, 180.0, 182.0, 183.0, 185.0, 190.0, 191.0, 193.0, 194.0, 196.0, 197.0, 199.0, 200.0, 202.0, 203.0, 205.0, 208.0, 209.0, 211.0, 212.0, 214.0, 215.0, 217.0, 218.0, 220.0, 221.0, 223.0, 224.0, 226.0, 227.0, 229.0, 230.0, 238.0, 239.0, 241.0, 242.0, 244.0, 245.0, 253.0, 255.0, 256.0, 266.0, 267.0, 269.0, 270.0, 282.0, 283.0, 285.0, 286.0, 295.0, 296.0, 298.0, 299.0, 301.0, 302.0, 313.0, 315.0, 316.0, 318.0, 326.0, 329.0, 330.0, 369.0, 370.0, 372.0, 373.0, 384.0, 385.0, 387.0,
Processing time: 0:00:01.922394
Queried mass list: ['85.000', '88.000', '91.000', '94.000', '97.000', '100.000', '103.000', '106.000', '109.000', '113.000', '116.000', '119.000', '122.000', '125.000', '128.000', '131.000', '134.000', '137.000', '141.000', '144.000', '147.000', '150.000', '153.000', '157.000', '161.000', '164.000', '167.000']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 85.0 (link to fragments) | 2 | 9 |
| 88.0 (link to fragments) | 1 | 1 |
| 91.0 | No match found! | No match found! |
| 94.0 (link to fragments) | 1 | 1 |
| 97.0 (link to fragments) | 1 | 1 |
| 100.0 | No match found! | No match found! |
| 103.0 | No match found! | No match found! |
| 106.0 | No match found! | No match found! |
| 109.0 | No match found! | No match found! |
| 113.0 | No match found! | No match found! |
| 116.0 | No match found! | No match found! |
| 119.0 (link to fragments) | 1 | 1 |
| 122.0 (link to fragments) | 1 | 1 |
| 125.0 (link to fragments) | 1 | 1 |
| 128.0 | No match found! | No match found! |
| 131.0 | No match found! | No match found! |
| 134.0 | No match found! | No match found! |
| 137.0 | No match found! | No match found! |
| 141.0 | No match found! | No match found! |
| 144.0 | No match found! | No match found! |
| 147.0 (link to fragments) | 1 | 5 |
| 150.0 (link to fragments) | 2 | 6 |
| 153.0 (link to fragments) | 2 | 6 |
| 157.0 | No match found! | No match found! |
| 161.0 (link to fragments) | 1 | 1 |
| 164.0 (link to fragments) | 1 | 1 |
| 167.0 (link to fragments) | 1 | 1 |