Mol:LBF11000BC09
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 14 13 0 0 1 0 0 0 0 0999 V2000 -3.1698 0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8635 1.8401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1605 1.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1605 2.0633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3087 1.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7212 0.3577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3087 -0.3567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7212 -1.0712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3087 -1.7857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7212 -2.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 2.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7574 1.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1698 1.7866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1698 0.3577 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 4 0 0 0 3 5 1 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 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 10 1 4 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 S SKP 5 ID LBF11000BC09 FORMULA C12H24O2 EXACTMASS 200.17763001199998 AVERAGEMASS 200.31776 SMILES CCC(C)CCCCCCCC(O)=O M END