Mol:LBF12110BC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 21 20 0 0 0 0 0 0 0 0999 V2000 -0.1635 0.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3217 0.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 0.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6517 0.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6153 0.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9765 0.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9692 0.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0296 -0.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2053 -0.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2068 -0.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0311 -0.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4432 0.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0515 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2272 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.5362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0093 -0.5362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4214 0.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 0.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9765 1.1389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9765 -0.2888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 3 1 0 0 0 0 5 1 1 0 0 0 0 1 6 1 0 0 0 0 5 9 1 0 0 0 0 7 13 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 6 14 1 0 0 0 0 8 18 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 3 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 S SKP 5 ID LBF12110BC01 FORMULA C19H36O2 EXACTMASS 296.271530396 AVERAGEMASS 296.48794000000004 SMILES CCCCCCCC(CCCCCCC)C=C(C)C(O)=O M END