Mol:Ingenane

 
 
Copyright: ARM project http://www.metabolomics.jp/ 
 20 23  0  0  0  0  0  0  0  0999 V2000 
    0.1248    0.4161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1248    1.2411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9094    0.1612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3943    0.8286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9094    1.4961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2193    0.8286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5202    1.7555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3245    1.5719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6825    0.8286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3245    0.0853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5202   -0.0982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7370    2.2864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2706   -0.7616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5367   -0.3491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1788   -1.0924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6256   -1.2760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4224   -1.4895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6360   -2.2864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2193   -1.7030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3336   -0.5626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0 
  1  3  1  0 
  3  4  1  0 
  4  5  1  0 
  5  2  1  0 
  4  6  1  0 
  2  7  1  0 
  7  8  1  0 
  8  9  1  0 
  9 10  1  0 
 10 11  1  6 
  1 11  1  6 
  8 12  1  0 
 14 15  1  0 
 15 16  1  0 
 16 13  1  0 
 14  1  1  0 
 13 10  1  0 
 16 17  1  1 
 13 17  1  1 
 17 18  1  1 
 17 19  1  6 
 14 20  1  6 
S  SKP  6 
AUTODRAW	FALSE 
ID	Ingenane 
FORMULA	C20H34 
EXACTMASS	274.266051088 
AVERAGEMASS	274.48396 
SMILES	CC(C3)CC(C2)C(C(CC(C)C(C4)2C3CC(C)4)1)C(C)(C)1 
M  END