Metabolite list

 

  Number Compound Ret. Time(min) Observed mass(Da) Exact mass (Da) Molecular formula Main fragments Organism KEGG COMPOUND
 
  mr1502 unknown 14.86 319.2263 147.1, 175.1, 119.1, 105.1
  mr1504 Arabidopyl shikimic acid 9.70 353.0864 353.0867 C16H16O9 153.0, 307.1, 275.1, 229.0 Arabidopsis thaliana
  mr1505 unknown 13.06 451.1070 177.1, 333.1, 243.0, 145.0
  mr1506 unknown 16.35 476.2766 335.3, 415.2, 261.2, 62.1
  mr1508 unknown 16.10 696.3468 358.2, 615.3, 277.1
  mr1509 unknown 6.78 122.0269 59.0, 107.1, 99.0, 91.0, 76.1
  mr1510 unknown 7.73 135.1168 91.1, 119.1, 107.1, 93.1, 77.1
  mr1511 unknown 8.27 65.1, 136.1, 110.0, 93.1, 81.1
  mr1512 unknown 19.75 149.1, 209.1, 97.1, 85.1
  mr1514 unknown 6.40 163.0