Mol:LBF09107BC01

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 12 11  0  0  1  0  0  0  0  0999 V2000 
   -0.5234    0.3845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8105    0.0820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6116   -1.0445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6215   -1.3470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0166   -0.7810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6160   -0.6325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0285    0.0820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0166    1.0445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4291    1.7590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8135    0.8309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0241   -1.7590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0241   -0.7149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  3  2  0  0  0  0 
  2  7  1  0  0  0  0 
  3  4  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 
  1  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  8 10  1  0  0  0  0 
  3 11  1  0  0  0  0 
  2 12  1  0  0  0  0 
S  SKP  5 
ID	LBF09107BC01 
FORMULA	C10H18O2 
EXACTMASS	170.13067981999998 
AVERAGEMASS	170.24872 
SMILES	CCCCCCC(C)=CC(O)=O 
M  END