Mol:LBF12000BC13

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LBF12000BC13.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 15 14  0  0  1  0  0  0  0  0999 V2000 
   -4.3322    1.6015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9566    1.6015    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    0.5484    1.6015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9566    2.6705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1752    1.6015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3039    1.6015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8928    0.8895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3039    0.1775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8928   -0.5345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3039   -1.2465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8928   -1.9585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3039   -2.6705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9211    1.6015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.3322    2.3135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.3322    0.8895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  2  3  1  0  0  0  0 
  2  4  1  4  0  0  0 
  3  5  1  0  0  0  0 
  1  6  1  0  0  0  0 
  2 12  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 
  5 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 13 15  1  0  0  0  0 
S  SKP  5 
ID	LBF12000BC13 
FORMULA	C13H26O2 
EXACTMASS	214.19328007599998 
AVERAGEMASS	214.34433999999996 
SMILES	CCCCCCCCC(C)CCC(O)=O 
M  END
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