Mol:BMMCBZ2Od006

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 10 10  0  0  0  0  0  0  0  0999 V2000 
    3.7321    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    0.2500    0.0000 Cl  0  0  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 
  1  7  1  0  0  0  0 
  2 10  1  0  0  0  0 
  7  8  1  0  0  0  0 
  7  9  2  0  0  0  0 
S  SKP  7 
ID	BMMCBZ2Od006 
NAME	2-Chloro-benzoic acid 
FORMULA	C7H5ClO2 
EXACTMASS	155.9978 
AVERAGEMASS	156.566 
SMILES	OC(=O)c(c1)c(Cl)ccc1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02357 
M  END