Mol:LBF11109BC01
Copyright: ARM project http://www.metabolome.jp/
14 13 0 0 0 0 0 0 0 0999 V2000 2.5484 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9775 -0.2077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 1.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7234 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0089 0.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2944 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4175 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1295 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8415 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5535 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2655 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2944 -1.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9775 -0.2077 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 2 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 1 0 7 13 1 0 12 14 1 0
S SKP 6 ID LBF11109BC01 FORMULA C12H22O2 EXACTMASS 198.16197994799998 AVERAGEMASS 198.30187999999998 SMILES CCCCCCC(C)CC=CC(O)=O AUTODRAW FALSE M END