Mol:LBF12000BC07
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 15 14 0 0 1 0 0 0 0 0999 V2000 -0.8099 0.5741 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6542 0.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8099 1.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3598 0.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2811 0.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9487 0.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3598 1.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3598 -0.1378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4088 -1.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4133 -1.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8244 -0.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6465 -0.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0576 -0.1378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8797 -0.1378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2908 0.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 4 0 0 0 5 2 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 1 9 1 0 0 0 0 4 15 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 14 15 1 0 0 0 0 S SKP 5 ID LBF12000BC07 FORMULA C13H26O2 EXACTMASS 214.19328007599998 AVERAGEMASS 214.34433999999996 SMILES CCCCCCCCC(C)CCC(O)=O M END
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