Mol:LBF08000BC02
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 11 10 0 0 0 0 0 0 0 0999 V2000 -1.3001 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8831 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7171 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1341 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0319 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7483 -0.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -0.7026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7469 0.5363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8831 0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 3 1 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 8 10 2 0 0 0 0 2 11 1 0 0 0 0 S SKP 5 ID LBF08000BC02 FORMULA C9H18O2 EXACTMASS 158.13067981999998 AVERAGEMASS 158.23802 SMILES CC(C)CCCCCC(O)=O M END