Mol:BMMCACCHp016

 
 
Copyright: ARM project http://www.metabolome.jp/ 
  8  8  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 O   0  0  0  0  0  0  0  0  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  1  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  2  8  2  0  0  0  0 
  3  4  1  0  0  0  0 
  1  7  2  0  0  0  0 
S  SKP  7 
ID	BMMCACCHp016 
NAME	Cyclohexan-1,2-dione 
FORMULA	C6H8O2 
EXACTMASS	112.0524 
AVERAGEMASS	112.1265 
SMILES	O=C(C1)C(=O)CCC1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C06105 
M  END