Mol:LBF08000BC01

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LBF08000BC01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 11 10  0  0  1  0  0  0  0  0999 V2000
   -1.3001   -0.2076    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.8831    0.3753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4660   -0.2076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7171    0.3753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1341   -0.2076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4490    0.3753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0319   -0.2076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7483    0.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4660   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7469    1.0326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3001   -1.0326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  2  3  1  0  0  0  0
  4  1  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  1 11  1  4  0  0  0
S  SKP  5
ID	LBF08000BC01
FORMULA	C9H18O2
EXACTMASS	158.13067981999998
AVERAGEMASS	158.23802
SMILES	CCC(C)CCCCC(O)=O
M  END

</pre>

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