Mol:BMFYS8CA0002

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BMFYS8CA0002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 10  9  0  0  0  0  0  0  0  0999 V2000
    2.8660    2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.0000    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
    4.5981   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    3.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  4  5  1  0  0  0  0
  9  1  1  0  0  0  0
  5  6  1  0  0  0  0
  2  3  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  3  4  1  0  0  0  0
  1 10  2  0  0  0  0
S  SKP  7
ID	BMFYS8CA0002
NAME	Octanoic acid
FORMULA	C8H16O2
EXACTMASS	144.115
AVERAGEMASS	144.2114
SMILES	CCCCCCCC(O)=O
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C06423
M  END

</pre>

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