Mol:LBF12000OX02
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 15 14 0 0 0 0 0 0 0 0999 V2000 1.4289 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2868 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 0.6188 0.0000 O 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 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 1 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 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 11 15 2 0 0 0 0 S SKP 5 ID LBF12000OX02 FORMULA C12H22O3 EXACTMASS 214.15689457 AVERAGEMASS 214.30128 SMILES CCCC(=O)CCCCCCCC(O)=O M END
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