Mol:LBF09000SC01

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 11 10  0  0  0  0  0  0  0  0999 V2000 
    2.0639   -0.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7789   -0.5961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0639    0.6428    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4506   -0.6428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9556   -0.1478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2943   -0.6414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -0.9487   -0.5507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5331    0.0337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1959   -0.4599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7789    0.1231    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 
S  SKP  5 
ID	LBF09000SC01 
FORMULA	C9H18O2 
EXACTMASS	158.13067981999998 
AVERAGEMASS	158.23802 
SMILES	CCCCCCCCC(O)=O 
M  END