Mol:LBF08106BC02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 13 12 0 0 1 0 0 0 0 0999 V2000 -0.2516 -0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6266 -0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3341 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2516 0.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6266 0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8001 0.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9219 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3341 0.7139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3341 -0.7139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1599 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6644 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0766 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6266 -0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 4 0 0 0 4 6 1 0 0 0 0 2 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 1 10 1 4 0 0 0 3 12 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 2 13 2 0 0 0 0 S SKP 5 ID LBF08106BC02 FORMULA C11H20O2 EXACTMASS 184.14632988399998 AVERAGEMASS 184.2753 SMILES CCCCC(CC)C=C(C)C(O)=O M END