Marvin  05240611162D          

 11 12  0  0  0  0            999 V2000
    1.2479    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1811   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1811    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2480   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8000    0.0000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.6442    0.4147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6442   -0.4147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5334    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5334    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5334   -0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5334   -1.6500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  8  1  1  0  0  0  0
  8  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4 10  1  0  0  0  0
 10  2  1  0  0  0  0
  2  3  1  0  0  0  0
  8  5  1  0  0  0  0
  5 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  8  9  1  1  0  0  0
 10 11  1  1  0  0  0
M  END
> <ID>
CHEBI:41341

> <NAME>
1beta,4beta-bornane

> <STAR>
3

> <SECONDARY_ID>
CHEBI:35787; CHEBI:41338

> <SYNONYM>
CAMPHANE

> <IUPAC_NAME>
1beta,4beta-bornane; (1s,4s)-1,7,7-trimethylbicyclo[2.2.1]heptane

> <FORMULA>
C10H18

> <MASS>
138.24992

> <MONOISOTOPIC_MASS>
138.14085

> <CHARGE>
0

> <SMILES>
[H][C@]12CC[C@](C)(CC1)C2(C)C

> <INCHI>
InChI=1S/C10H18/c1-9(2)8-4-6-10(9,3)7-5-8/h8H,4-7H2,1-3H3/t8-,10+

> <INCHIKEY>
BEWYHVAWEKZDPP-WAAGHKOSSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1919081

> <PDBECHEM_ACCESSION>
CAE

$$$$