Mol:LBF10206SC01
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 12 11 0 0 0 0 0 0 0 0999 V2000 1.8762 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4894 -0.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2044 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4894 0.6291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8913 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5458 -0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2044 -0.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2162 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6112 -0.1616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0763 -0.1616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6538 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2038 -0.1616 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 5 6 1 0 0 0 0 6 7 1 0 0 0 0 1 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 5 12 1 0 0 0 0 S SKP 5 ID LBF10206SC01 FORMULA C10H16O2 EXACTMASS 168.11502975599998 AVERAGEMASS 168.23283999999998 SMILES CCCCCC=CC=CC(O)=O M END
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