13502875
  CDK     0811221958

 11 12  0  0  0  0  0  0  0  0999 V2000
    3.0789    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5083   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7934   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7934    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9208   -1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9208    0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3644   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3644    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  2  0  0  0  0 
  2  3  1  0  0  0  0 
  2  4  1  0  0  0  0 
  2  6  1  0  0  0  0 
  2  7  1  0  0  0  0 
  3  4  1  0  0  0  0 
  3  5  1  0  0  0  0 
  4  8  1  0  0  0  0 
  5  9  1  0  0  0  0 
  8 10  1  0  0  0  0 
  9 10  2  0  0  0  0 
  9 11  1  0  0  0  0 
M  END
> <ID>
CHEBI:192933

> <NAME>
3-Caren-5-one

> <STAR>
2

> <IUPAC_NAME>
4,7,7-trimethylbicyclo[4.1.0]hept-3-en-2-one

> <FORMULA>
C10H14O

> <MASS>
150.221

> <MONOISOTOPIC_MASS>
150.10447

> <CHARGE>
0

> <SMILES>
O=C1C2C(C2CC(=C1)C)(C)C

> <INCHI>
InChI=1S/C10H14O/c1-6-4-7-9(8(11)5-6)10(7,2)3/h5,7,9H,4H2,1-3H3

> <INCHIKEY>
WDILKLCBAXJFIA-UHFFFAOYSA-N

$$$$