Mol:LBF23101SC01

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LBF23101SC01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 24  0  0  0  0  0  0  0  0999 V2000
    3.3234    0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9366    0.5851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6516    0.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9366    1.4128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7184    0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0419    0.1478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3901    0.6511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7136    0.1767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0591    0.6813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6174    0.2069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2691    0.7102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9456    0.2358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6001    0.7404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2766    0.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9641    0.7872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6516    0.2358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6516   -0.8903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9641   -1.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2766   -0.8353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6208   -1.3331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9883   -0.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3296   -1.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6999   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0440   -1.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5885   -0.7349    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
  1  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
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  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
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
S  SKP  5
ID	LBF23101SC01
FORMULA	C23H44O2
EXACTMASS	352.334130652
AVERAGEMASS	352.59426
SMILES	C(CCC(O)=O)CCCCCCCCCCCCCCCCCC=C
M  END

</pre>

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