Mol:LBF19000XX01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 21 0 0 1 0 0 0 0 0999 V2000 -0.6524 0.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0668 0.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5163 0.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0993 0.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6823 0.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2653 0.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2355 0.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8185 0.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4015 0.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9831 0.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9857 -0.2805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6994 0.9624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9844 0.4124 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9844 -0.4126 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4015 -0.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8185 -0.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2355 -0.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6524 -0.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0694 -0.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5135 -0.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6994 -0.0001 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 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 7 1 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 6 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 9 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 13 21 1 4 0 0 0 14 21 1 4 0 0 0 S SKP 5 ID LBF19000XX01 FORMULA C19H36O2 EXACTMASS 296.271530396 AVERAGEMASS 296.48794000000004 SMILES C(C(CCCCCCCCCC(O)=O)1)(CCCCCC)C1 M END