Mol:LBF08105SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 10 9 0 0 0 0 0 0 0 0999 V2000 1.0814 -0.5528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6947 -0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4097 -0.5335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6947 0.7054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5589 -0.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2661 -0.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7886 -0.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2561 -0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8391 -0.7054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4097 -0.1128 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 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 S SKP 5 ID LBF08105SC01 FORMULA C8H14O2 EXACTMASS 142.09937969199999 AVERAGEMASS 142.19556 SMILES CCCCC=CCC(O)=O M END