Mol:LBF12000BC14

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LBF12000BC14.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 16 15  0  0  1  0  0  0  0  0999 V2000
   -2.4817    2.1079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8533    2.1079    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.5625    3.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8505    3.1770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6595    2.1079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2485    1.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6595    0.6839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2485   -0.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6595   -0.7401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2485   -1.4521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6595   -2.1641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2485   -2.8761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6595   -3.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0706    2.1079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4817    2.8199    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4817    1.3959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2 13  1  4  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
  2 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
S  SKP  5
ID	LBF12000BC14
FORMULA	C14H28O2
EXACTMASS	228.20893013999998
AVERAGEMASS	228.37091999999998
SMILES	CCCCCCCCCCC(CC)C(O)=O
M  END

</pre>

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