Mol:LBF12110CA01
(Redirected from Mol:LBF121nnCA01)
Copyright: ARM project http://www.metabolome.jp/
16 15 0 0 0 0 0 0 0 0999 V2000 3.2064 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9211 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6355 -0.2077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9211 1.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4918 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7773 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0629 0.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3484 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3636 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0756 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7876 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4996 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2116 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9236 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9236 -1.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6355 0.2034 0.0000 O 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 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0
S SKP 6 ID LBF12110CA01 FORMULA C12H20O4 EXACTMASS 228.13615912799997 AVERAGEMASS 228.2848 SMILES OC(=O)CCCCCCCCC=CC(O)=O AUTODRAW FALSE M END
