Mol:LBF09000HO02
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 12 11 0 0 1 0 0 0 0 0999 V2000 0.8504 -0.1210 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4334 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0604 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6476 -0.6201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0659 0.6462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2674 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3156 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8986 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4816 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0646 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6476 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8504 0.7040 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 1 12 1 4 0 0 0 S SKP 5 ID LBF09000HO02 FORMULA C9H18O3 EXACTMASS 174.125594442 AVERAGEMASS 174.23742 SMILES CCCCCCC(O)CC(O)=O M END
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