Mol:LBF08000OX05

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 11 10  0  0  0  0  0  0  0  0999 V2000 
    0.0000   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579   -0.2063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434    1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7145    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1434    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8579   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289   -1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  4  6  2  0  0  0  0 
  1  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 
  8 11  2  0  0  0  0 
S  SKP  5 
ID	LBF08000OX05 
FORMULA	C8H14O3 
EXACTMASS	158.094294314 
AVERAGEMASS	158.19495999999998 
SMILES	CCC(=O)CCCCC(O)=O 
M  END