Mol:BMMCBZ2On019
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 10 10 0 0 0 0 0 0 0 0999 V2000 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6 1 2 0 0 0 0 6 5 1 0 0 0 0 5 4 2 0 0 0 0 4 3 1 0 0 0 0 3 2 2 0 0 0 0 2 1 1 0 0 0 0 2 8 1 0 0 0 0 1 7 1 0 0 0 0 8 10 1 0 0 0 0 8 9 2 0 0 0 0 S SKP 7 ID BMMCBZ2On019 NAME 2-Nitrophenol FORMULA C6H5NO3 EXACTMASS 139.0269 AVERAGEMASS 139.1088 SMILES Oc(c1)c(ccc1)[N+1]([O-1])=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01988 M END