Mol:LBF10000HO03

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 13 12  0  0  1  0  0  0  0  0999 V2000 
    1.1419    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7249   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3519    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9391   -0.1787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3574    1.0876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5589   -0.2626    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
   -0.0241    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6071   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1901    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7731   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3561    0.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9391   -0.2626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5589   -1.0876    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 
  3  5  2  0  0  0  0 
  1  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 
  6 13  1  4  0  0  0 
S  SKP  5 
ID	LBF10000HO03 
FORMULA	C10H20O3 
EXACTMASS	188.141244506 
AVERAGEMASS	188.264 
SMILES	CCCCCCC(O)CCC(O)=O 
M  END