102667
  DSViewer          3D                             0

 27 28  0  0  0  0  0  0  0  0999 V2000
    2.3297   -1.2632   -0.6558 O   0  0  0  0  0  0  0  0  0  1
    6.3659    0.0643   -0.3386 C   0  0  0  0  0  0  0  0  0  2
    5.3100    1.1769   -0.4939 C   0  0  3  0  0  0  0  0  0  3
    5.6542   -0.3033    0.9702 C   0  0  3  0  0  0  0  0  0  4
    5.2315    1.2294    1.0452 C   0  0  0  0  0  0  0  0  0  5
    3.9745    0.5935   -1.1130 C   0  0  0  0  0  0  0  0  0  6
    4.4205   -1.1389    0.6460 C   0  0  0  0  0  0  0  0  0  7
    3.3111   -0.4061   -0.0747 C   0  0  3  0  0  0  0  0  0  8
    6.3719   -1.0236   -1.4551 C   0  0  0  0  0  0  0  0  0  9
    7.7764    0.6389   -0.0852 C   0  0  0  0  0  0  0  0  0 10
    4.2293   -2.3452    1.1773 C   0  0  0  0  0  0  0  0  0 11
    5.7256    2.0598   -0.9986 H   0  0  0  0  0  0  0  0  0 12
    6.3262   -0.6756    1.7552 H   0  0  0  0  0  0  0  0  0 13
    5.9548    1.8884    1.5256 H   0  0  0  0  0  0  0  0  0 14
    4.2391    1.4188    1.4541 H   0  0  0  0  0  0  0  0  0 15
    3.2841    1.4099   -1.3251 H   0  0  0  0  0  0  0  0  0 16
    4.2030    0.0612   -2.0363 H   0  0  0  0  0  0  0  0  0 17
    2.8124    0.2051    0.6938 H   0  0  0  0  0  0  0  0  0 18
    8.4893   -0.1791    0.0181 H   0  0  0  0  0  0  0  0  0 19
    7.7689    1.2313    0.8297 H   0  0  0  0  0  0  0  0  0 20
    8.0681    1.2706   -0.9243 H   0  0  0  0  0  0  0  0  0 21
    7.1525   -1.7551   -1.2463 H   0  0  0  0  0  0  0  0  0 22
    6.5636   -0.5539   -2.4199 H   0  0  0  0  0  0  0  0  0 23
    5.4037   -1.5238   -1.4810 H   0  0  0  0  0  0  0  0  0 24
    4.9659   -2.7610    1.8648 H   0  0  0  0  0  0  0  0  0 25
    3.3362   -2.9167    0.9245 H   0  0  0  0  0  0  0  0  0 26
    1.6201   -0.7145   -1.0716 H   0  0  0  0  0  0  0  0  0 27
  1  8  1  0  0  0
  1 27  1  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  2  9  1  0  0  0
  2 10  1  0  0  0
  3  5  1  0  0  0
  3  6  1  0  0  0
  3 12  1  0  0  0
  4  5  1  0  0  0
  4  7  1  0  0  0
  4 13  1  0  0  0
  5 14  1  0  0  0
  5 15  1  0  0  0
  6  8  1  0  0  0
  6 16  1  0  0  0
  6 17  1  0  0  0
  7  8  1  0  0  0
  7 11  2  0  0  0
  8 18  1  0  0  0
  9 22  1  0  0  0
  9 23  1  0  0  0
  9 24  1  0  0  0
 10 19  1  0  0  0
 10 20  1  0  0  0
 10 21  1  0  0  0
 11 25  1  0  0  0
 11 26  1  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
102667

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
205

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
1

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBwIAAAAAAAAAAAAAAAAABgAAAAAAAwYAAAAAAAAAAAAAAAGgAACAAADxSggAICAAAAAgCAAgBCAAAAAAAgAAAAAAAAAAgAFAIAAQAAQAAEgAAAEAGAwPAPgAAAAAAAAABAAAIAACAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
6,6-dimethyl-2-methylene-norpinan-3-ol

> <PUBCHEM_IUPAC_CAS_NAME>
6,6-dimethyl-4-methylene-3-bicyclo[3.1.1]heptanol

> <PUBCHEM_IUPAC_NAME>
6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
6,6-dimethyl-4-methylidene-bicyclo[3.1.1]heptan-3-ol

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
6,6-dimethyl-2-methylene-norpinan-3-ol

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h7-9,11H,1,4-5H2,2-3H3

> <PUBCHEM_IUPAC_INCHIKEY>
LCYXQUJDODZYIJ-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
1.8

> <PUBCHEM_EXACT_MASS>
152.12

> <PUBCHEM_MOLECULAR_FORMULA>
C10H16O

> <PUBCHEM_MOLECULAR_WEIGHT>
152.233

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1(C2CC1C(=C)C(C2)O)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1(C2CC1C(=C)C(C2)O)C

> <PUBCHEM_CACTVS_TPSA>
20.2

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
152.12

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
11

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
3

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
8  1  3
3  2  3
4  2  3

$$$$
