Mol:BMMCBZ2Od013

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BMMCBZ2Od013.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
  8  8  0  0  0  0  0  0  0  0999 V2000
    3.7321    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.0000    0.0000 I   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
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
S  SKP  7
ID	BMMCBZ2Od013
NAME	2-Iodo-phenol
FORMULA	C6H5IO
EXACTMASS	219.9385
AVERAGEMASS	220.008
SMILES	Oc(c1)c(I)ccc1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01874
M  END

</pre>

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