1-(adamantan-1-yl)butane-1,3-dione
  -molcms-06262611092D

 16 18  0  0  0  0  0  0  0  0999 V2000
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    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7382    0.0678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1573   -0.6582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6469   -1.5302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5336   -0.0008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6498    1.5299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1444    0.7525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8814    1.5278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8838   -1.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5001    0.8658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4999   -0.8663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4999   -0.8665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -0.0005    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9997   -1.7326    0.0000 C   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
  4  5  1  0  0  0  0
  5  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  4  1  0  0  0  0
  8 10  1  0  0  0  0
 10  2  1  0  0  0  0
  6 11  1  0  0  0  0
 11  2  1  0  0  0  0
  1 12  2  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
M  END
>  <ProductName>
1-(adamantan-1-yl)butane-1,3-dione

>  <CASNumber>
82094-52-8

>  <MolecularFormula>
C14H20O2

>  <MDLNo>
MFCD09035442

>  <MolWt>
220.31

>  <BoilingPoint>


>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
C(C12CC3CC(CC(C3)C1)C2)(=O)CC(=O)C

$$$$