Mol:LBF10204SC02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 12 11 0 0 0 0 0 0 0 0999 V2000 1.6191 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2323 -0.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9473 -0.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2323 0.6566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0966 -0.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5741 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0419 -0.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6579 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3509 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8184 -0.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3959 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9473 -0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 1 5 2 0 0 0 0 5 6 1 0 0 0 0 7 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 S SKP 5 ID LBF10204SC02 FORMULA C10H16O2 EXACTMASS 168.11502975599998 AVERAGEMASS 168.23283999999998 SMILES CCCC=CCCC=CC(O)=O M END