Mol:LBF13102SC01
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 15 14 0 0 0 0 0 0 0 0999 V2000 2.9439 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5571 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2721 -0.5658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5571 0.6731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3389 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7064 -0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0546 -0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3919 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2448 -0.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8786 -0.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5359 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2082 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9067 -0.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5764 -0.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2721 -0.2317 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 7 8 1 0 0 0 0 1 5 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 S SKP 5 ID LBF13102SC01 FORMULA C13H24O2 EXACTMASS 212.17763001199998 AVERAGEMASS 212.32845999999998 SMILES CC=CCCCCCCCCCC(O)=O M END
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