Mol:BMMCBZ1Sk048

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 11 11  0  0  0  0  0  0  0  0999 V2000 
    6.3301   -0.5000    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   -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 
    2.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.5000    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 
    6.3301   -1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  4  9  2  0  0  0  0 
  9  8  1  0  0  0  0 
  4  3  1  0  0  0  0 
  8  7  2  0  0  0  0 
  3  2  1  0  0  0  0 
  7  6  1  0  0  0  0 
  2  1  1  0  0  0  0 
  6  5  2  0  0  0  0 
  5  4  1  0  0  0  0 
  1 10  1  0  0  0  0 
  1 11  2  0  0  0  0 
S  SKP  7 
ID	BMMCBZ1Sk048 
NAME	Phenyl-propanoic acid 
FORMULA	C9H10O2 
EXACTMASS	150.068 
AVERAGEMASS	150.1745 
SMILES	OC(=O)CCc(c1)cccc1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C05629 
M  END