Mol:LBF13111SC01

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LBF13111SC01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 15 14  0  0  0  0  0  0  0  0999 V2000
    2.9439   -0.5851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5571   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2721   -0.5658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5571    0.6731    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3389   -0.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7064   -0.5851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0546   -0.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3919   -0.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2448   -0.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8786   -0.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5359   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2082   -0.6359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9067   -0.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5764   -0.6731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2721   -0.2317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  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
  1  5  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
S  SKP  5
ID	LBF13111SC01
FORMULA	C13H24O2
EXACTMASS	212.17763001199998
AVERAGEMASS	212.32845999999998
SMILES	CCCCCCCCCCC=CC(O)=O
M  END

</pre>

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