Mol:LBF16000HO05
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 19 18 0 0 0 0 0 0 0 0999 V2000 3.3865 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9695 -0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1837 -0.5360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 0.7303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8036 -0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2206 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6375 -0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0545 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4715 -0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1114 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6944 -0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 0.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0534 -0.7303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6367 -0.1469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2201 -0.7303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8035 -0.1469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6003 -0.3604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1837 0.2229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 1 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 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 S SKP 5 ID LBF16000HO05 FORMULA C16H32O3 EXACTMASS 272.23514489 AVERAGEMASS 272.42348 SMILES OCCCCCCCCCCCCCCCC(O)=O M END