Mol:LBF12000BC09

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LBF12000BC09.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 15 14  0  0  1  0  0  0  0  0999 V2000 
   -0.4235    0.2181    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
   -0.4235    1.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9734    0.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4380   -1.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2601   -1.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6712   -0.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4933   -0.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9044    0.2182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5623    0.2182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9734    0.9301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9734   -0.4938    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0378    0.2182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4489   -0.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2710   -0.4938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6821   -1.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  4  0  0  0 
  1  4  1  0  0  0  0 
  3  8  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 
  9 10  2  0  0  0  0 
  9 11  1  0  0  0  0 
  1 12  1  0  0  0  0 
  9 15  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	LBF12000BC09 
FORMULA	C13H26O2 
EXACTMASS	214.19328007599998 
AVERAGEMASS	214.34433999999996 
SMILES	CCCCCCC(C)CCCCC(O)=O 
M  END
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