Mol:BMMCBZ2Pq048

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BMMCBZ2Pq048.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
  8  8  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
    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
    4.5981   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6  1  1  0  0  0  0
  5  6  2  0  0  0  0
  1  7  2  0  0  0  0
  4  8  1  0  0  0  0
S  SKP  7
ID	BMMCBZ2Pq048
NAME	p-Benzosemiquinone
FORMULA	C6H6O2
EXACTMASS	110.0367
AVERAGEMASS	110.1106
SMILES	OC(C=1)C=CC(=O)C1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02389
M  END

</pre>

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