Mol:BMFYS2CAd002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
  5  4  0  0  0  0  0  0  0  0999 V2000 
    2.8660   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    1.2500    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  2  1  1  0  0  0  0 
  3  2  1  0  0  0  0 
  1  4  1  0  0  0  0 
  1  5  2  0  0  0  0 
S  SKP  7 
ID	BMFYS2CAd002 
NAME	Chloro-acetic acid 
FORMULA	C2H3ClO2 
EXACTMASS	93.9821 
AVERAGEMASS	94.4967 
SMILES	OC(=O)CCl 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C06755 
M  END