Mol:LBF10000SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 12 11 0 0 0 0 0 0 0 0999 V2000 2.6187 -0.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3337 -0.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6187 0.6586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0054 -0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3179 -0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6566 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0117 -0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6717 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3427 -0.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0054 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6737 -0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3337 -0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 4 1 1 0 0 0 0 4 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 10 11 1 0 0 0 0 11 12 1 0 0 0 0 S SKP 5 ID LBF10000SC01 FORMULA C10H20O2 EXACTMASS 172.14632988399998 AVERAGEMASS 172.2646 SMILES CCCCCCCCCC(O)=O M END