Mol:S-Perillaldehyde

 
  ACD/Labs11200718282D 
 
 11 11  0  0  1  0  0  0  0  0  1 V2000 
   28.9376   -5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   28.9376   -6.7541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.7857   -4.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   27.7857   -7.4191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   26.6339   -5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   26.6339   -6.7541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   25.4821   -7.4191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   30.0894   -4.7591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   31.2412   -5.4241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   30.0894   -3.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   24.3303   -6.7542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  2  1  1  0  0  0  0 
  3  1  1  0  0  0  0 
  4  2  1  0  0  0  0 
  5  3  1  0  0  0  0 
  6  4  2  0  0  0  0 
  6  5  1  0  0  0  0 
  6  7  1  0  0  0  0 
  1  8  1  6  0  0  0 
  8  9  1  0  0  0  0 
  8 10  2  0  0  0  0 
 11  7  2  0  0  0  0 
S  SKP  5 
ID	S-Perillaldehyde 
FORMULA	C10H14O 
EXACTMASS	150.10446507 
AVERAGEMASS	150.21756000000002 
SMILES	O=CC(C1)=CCC(C(C)=C)C1 
M  END