Mol:Test

 
 
Copyright: ARM project http://www.metabolomics.jp/ 
 15 17  0  0  0  0  0  0  0  0999 V2000 
   -1.9667    0.0064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9667   -0.8186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3217   -1.3330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5174   -1.1494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1594   -0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5174    0.3372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3217    0.5207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6072   -1.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0362   -1.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0660    0.9205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2045   -0.7716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0362    0.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9088    0.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0660    1.7455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7309    1.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0 
  2  3  1  0 
  3  4  1  0 
  4  5  1  0 
  5  6  1  0 
  6  7  1  0 
  7  1  1  0 
  3  8  1  0 
  3  9  1  0 
  6 10  1  0 
  5 11  1  0 
 11 12  1  0 
 12 13  1  0 
 13 10  1  0 
  4 13  1  6 
 10 14  2  0 
  6 15  1  1 
S  SKP  6 
AUTODRAW	FALSE 
ID	(+)-Longifolene.Mol 
FORMULA	C15H24 
EXACTMASS	204.187800768 
AVERAGEMASS	204.35106000000002 
SMILES	CC(C)(C2)C(C31)C(CC3)C(C)(CC2)C(=C)1 
M  END