Metabolite list

 

  Number Compound Ret. Time(min) Observed mass(Da) Exact mass (Da) Molecular formula Main fragments Organism KEGG COMPOUND
 
  qtl-m0100 225.1483 105.1, 189.2, 147.2, 133.1, 91.1, 79.1
  qtl-m0101 Sinapic acid 225.0758 225.0757 C11H12O5 147.1, 207.1, 192.1, 175.1, 119.1, 91.1
  qtl-m0102 268.0, 286.8, 250.7, 240.7, 137.1
  qtl-m0103 244.2, 200.5, 146.3
  qtl-m0104 98.9, 247.5, 177.3, 145.1
  qtl-m0105 Leu-pro 229.1542 229.1547 C11H20N2O3 142.3, 114.2, 96.2, 70.0, 65.0
  qtl-m0106 147.2, 119.1, 105.1, 91.1
  qtl-m0107 131.0, 113.1, 95.2, 84.9
  qtl-m0108 Dodecyl (dimethyl) amine oxide 230.248 230.2478 C14H31NO 212.1, 62.0, 99.0
  qtl-m0109 161.2, 133.1, 119.2, 95.1