Mol:LBF182nnXX02
Copyright: ARM project http://www.metabolome.jp/
20 20 0 0 0 0 0 0 0 0999 V2000 0.5758 0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1362 0.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8482 0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5602 0.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2722 0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9842 0.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6962 0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4081 0.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1928 0.5894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6777 -0.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1928 -0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4081 -0.4906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4008 0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1153 0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8272 0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5392 0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2512 0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9632 0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9632 -0.4920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6777 0.7455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 8 1 0 1 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0
S SKP 6 ID LBF182nnXX02 FORMULA C18H30O2 EXACTMASS 278.224580204 AVERAGEMASS 278.4296 SMILES OC(=O)CCCCC=CCCCCCCC(C1)C=CC1 AUTODRAW FALSE M END
