Mol:LBF10105BC01
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 0 0 0 0 0 0999 V2000 2.1962 -1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9109 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6253 -1.0334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9109 0.2041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4815 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7671 -1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0526 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4869 -1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2013 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9133 -1.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6253 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 0.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4869 0.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4869 1.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 1.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2013 1.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9133 -1.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 0 1 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 8 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 11 18 1 0
S SKP 6 ID LBF10105BC01 FORMULA C16H30O2 EXACTMASS 254.22458020399998 AVERAGEMASS 254.4082 SMILES CC(C)CCC=C(CCCC(O)=O)CCC(C)C AUTODRAW FALSE M END