Mol:BMAXS2AKt005

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BMAXS2AKt005.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 13 13  0  0  0  0  0  0  0  0999 V2000
    2.8660    2.0000    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
    3.7321    0.5000    0.0000 N   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
    4.5981   -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
    3.7321   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 10  5  2  0  0  0  0
 10  9  1  0  0  0  0
  9  8  2  0  0  0  0
  8  7  1  0  0  0  0
  7  6  2  0  0  0  0
  6  5  1  0  0  0  0
  4  3  1  0  0  0  0
  4 13  2  0  0  0  0
  5  4  1  0  0  0  0
  3  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  2  0  0  0  0
  2  1  1  0  0  0  0
S  SKP  7
ID	BMAXS2AKt005
NAME	N-Benzoyl-glycine
FORMULA	C9H9NO3
EXACTMASS	179.0582
AVERAGEMASS	179.1727
SMILES	OC(=O)CNC(=O)c(c1)cccc1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01586
M  END

</pre>

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