Mol:LBF12000SC01

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LBF12000SC01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 14 13  0  0  0  0  0  0  0  0999 V2000
    3.2856   -0.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0006   -0.5747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2856    0.6641    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6723   -0.6215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9848   -0.1265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3234   -0.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6552   -0.1389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0048   -0.6311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6758   -0.1485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3386   -0.6421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0068   -0.1609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6668   -0.6531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3378   -0.1705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0006   -0.6641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  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
  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
S  SKP  5
ID	LBF12000SC01
FORMULA	C12H24O2
EXACTMASS	200.17763001199998
AVERAGEMASS	200.31776
SMILES	CCCCCCCCCCCC(O)=O
M  END

</pre>

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