Mol:LBF09000HO05
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 12 11 0 0 0 0 0 0 0 0999 V2000 1.1419 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7249 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3519 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9391 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3574 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5589 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0241 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6071 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1901 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7731 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3561 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9391 -0.6751 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 S SKP 5 ID LBF09000HO05 FORMULA C9H18O3 EXACTMASS 174.125594442 AVERAGEMASS 174.23742 SMILES OCCCCCCCCC(O)=O M END
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