Mol:BMMCBZ2Pd015

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BMMCBZ2Pd015.png

<pre>

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
    4.5981   -0.5000    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
    2.8660   -0.5000    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
    3.7321    1.0000    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
    6.3301    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    1.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.0000    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
  4 10  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  3  0  0  0  0
S  SKP  7
ID	BMMCBZ2Pd015
NAME	4-Chloro-phenyl-acetonitrile
FORMULA	C8H6ClN
EXACTMASS	151.0188
AVERAGEMASS	151.5926
SMILES	N#CCc(c1)ccc(Cl)c1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C03679
M  END

</pre>

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