Mol:LBF11109SC01
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 13 12 0 0 0 0 0 0 0 0999 V2000 | + | 13 12 0 0 0 0 0 0 0 0999 V2000 |
− | 2.2612 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2612 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8744 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8744 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.5894 -0.5844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5894 -0.5844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8744 0.6545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8744 0.6545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6562 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6562 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0237 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0237 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3719 -0.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3719 -0.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2908 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2908 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9274 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9274 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5613 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5613 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2186 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2186 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8909 -0.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8909 -0.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.5894 -0.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5894 -0.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 2 4 2 0 0 0 0 | + | 2 4 2 0 0 0 0 |
− | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 1 5 2 0 0 0 0 | + | 1 5 2 0 0 0 0 |
− | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
− | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID LBF11109SC01 | + | ID LBF11109SC01 |
− | FORMULA C11H20O2 | + | FORMULA C11H20O2 |
− | EXACTMASS 184.14632988399998 | + | EXACTMASS 184.14632988399998 |
− | AVERAGEMASS 184.2753 | + | AVERAGEMASS 184.2753 |
− | SMILES CCCCCCCCC=CC(O)=O | + | SMILES CCCCCCCCC=CC(O)=O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 13 12 0 0 0 0 0 0 0 0999 V2000 2.2612 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8744 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5894 -0.5844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8744 0.6545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6562 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0237 -0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3719 -0.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2908 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9274 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5613 -0.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2186 -0.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8909 -0.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5894 -0.2118 0.0000 C 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 2 4 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 1 5 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 S SKP 5 ID LBF11109SC01 FORMULA C11H20O2 EXACTMASS 184.14632988399998 AVERAGEMASS 184.2753 SMILES CCCCCCCCC=CC(O)=O M END