Mol:BMMCBZ3Sd012
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 9 9 0 0 0 0 0 0 0 0999 V2000 | + | 9 9 0 0 0 0 0 0 0 0999 V2000 |
− | 3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
− | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
− | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
− | 6 5 2 0 0 0 0 | + | 6 5 2 0 0 0 0 |
− | 6 9 1 0 0 0 0 | + | 6 9 1 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 2 8 1 0 0 0 0 | + | 2 8 1 0 0 0 0 |
− | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
− | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMMCBZ3Sd012 | + | ID BMMCBZ3Sd012 |
− | NAME 2,6-Dichloro-phenol | + | NAME 2,6-Dichloro-phenol |
− | FORMULA C6H4Cl2O | + | FORMULA C6H4Cl2O |
− | EXACTMASS 161.9639 | + | EXACTMASS 161.9639 |
− | AVERAGEMASS 163.0007 | + | AVERAGEMASS 163.0007 |
− | SMILES Oc(c(Cl)1)c(Cl)ccc1 | + | SMILES Oc(c(Cl)1)c(Cl)ccc1 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C07096 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C07096 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 9 9 0 0 0 0 0 0 0 0999 V2000 3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 6 5 2 0 0 0 0 6 9 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 5 4 1 0 0 0 0 3 4 2 0 0 0 0 S SKP 7 ID BMMCBZ3Sd012 NAME 2,6-Dichloro-phenol FORMULA C6H4Cl2O EXACTMASS 161.9639 AVERAGEMASS 163.0007 SMILES Oc(c(Cl)1)c(Cl)ccc1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C07096 M END