Mol:LBF13000SC01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 15 14 0 0 0 0 0 0 0 0999 V2000 3.6197 -0.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3347 -0.5747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6197 0.6641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0064 -0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3189 -0.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6576 -0.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9893 -0.1389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3293 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3417 -0.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0044 -0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6727 -0.1609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3327 -0.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0037 -0.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6664 -0.6641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3347 -0.1829 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 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 S SKP 5 ID LBF13000SC01 FORMULA C13H26O2 EXACTMASS 214.19328007599998 AVERAGEMASS 214.34433999999996 SMILES CCCCCCCCCCCCC(O)=O M END