79035
  DSViewer          3D                             0

 26 28  0  0  0  0  0  0  0  0999 V2000
    2.3224    0.1751   -0.7437 C   0  0  0  0  0  0  0  0  0  1
    1.9164    0.7905    0.5680 C   0  0  3  0  0  0  0  0  0  2
    1.5968   -0.7032    0.2392 C   0  0  3  0  0  0  0  0  0  3
    3.8007   -0.1560   -0.6768 C   0  0  0  0  0  0  0  0  0  4
    3.7635   -0.4831    0.8452 C   0  0  0  0  0  0  0  0  0  5
    3.1504    0.8136    1.4839 C   0  0  0  0  0  0  0  0  0  6
    2.6395   -1.5735    0.9584 C   0  0  0  0  0  0  0  0  0  7
    1.5882    0.6137   -2.0222 C   0  0  0  0  0  0  0  0  0  8
    4.1904   -1.3754   -1.5359 C   0  0  0  0  0  0  0  0  0  9
    4.7088    1.0465   -1.0027 C   0  0  0  0  0  0  0  0  0 10
    0.5577   -0.9938    0.0316 H   0  0  0  0  0  0  0  0  0 11
    1.0959    1.5210    0.5852 H   0  0  0  0  0  0  0  0  0 12
    4.7303   -0.7838    1.2715 H   0  0  0  0  0  0  0  0  0 13
    2.3690   -1.8092    1.9877 H   0  0  0  0  0  0  0  0  0 14
    2.8758   -2.4939    0.4244 H   0  0  0  0  0  0  0  0  0 15
    3.7729    1.6978    1.3471 H   0  0  0  0  0  0  0  0  0 16
    2.9061    0.7004    2.5401 H   0  0  0  0  0  0  0  0  0 17
    1.9981    0.0788   -2.8789 H   0  0  0  0  0  0  0  0  0 18
    1.7194    1.6860   -2.1675 H   0  0  0  0  0  0  0  0  0 19
    0.5261    0.3876   -1.9276 H   0  0  0  0  0  0  0  0  0 20
    5.7533    0.7420   -0.9371 H   0  0  0  0  0  0  0  0  0 21
    4.5194    1.8491   -0.2899 H   0  0  0  0  0  0  0  0  0 22
    4.4966    1.3997   -2.0119 H   0  0  0  0  0  0  0  0  0 23
    5.2609   -1.5583   -1.4435 H   0  0  0  0  0  0  0  0  0 24
    3.9447   -1.1787   -2.5795 H   0  0  0  0  0  0  0  0  0 25
    3.6415   -2.2524   -1.1929 H   0  0  0  0  0  0  0  0  0 26
  1  2  1  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  1  8  1  0  0  0
  2  3  1  0  0  0
  2  6  1  0  0  0
  2 12  1  0  0  0
  3  7  1  0  0  0
  3 11  1  0  0  0
  4  5  1  0  0  0
  4  9  1  0  0  0
  4 10  1  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  5 13  1  0  0  0
  6 16  1  0  0  0
  6 17  1  0  0  0
  7 14  1  0  0  0
  7 15  1  0  0  0
  8 18  1  0  0  0
  8 19  1  0  0  0
  8 20  1  0  0  0
  9 24  1  0  0  0
  9 25  1  0  0  0
  9 26  1  0  0  0
 10 21  1  0  0  0
 10 22  1  0  0  0
 10 23  1  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
79035

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
190

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBwAAAAAAAAAAAAAAAAGAAAAYMGAAAAAAAAAAAAAAAAAAAAGAAAAAAADwCAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAEAgMAPgAAAAAAAAACAAAQAACAAAQAACAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane

> <PUBCHEM_IUPAC_CAS_NAME>
6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane

> <PUBCHEM_IUPAC_NAME>
6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
6,7,7-trimethyl-2,3,4,5-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptane

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C10H16/c1-9(2)6-4-7-8(5-6)10(7,9)3/h6-8H,4-5H2,1-3H3

> <PUBCHEM_IUPAC_INCHIKEY>
RRBYUSWBLVXTQN-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
3.2

> <PUBCHEM_EXACT_MASS>
136.125

> <PUBCHEM_MOLECULAR_FORMULA>
C10H16

> <PUBCHEM_MOLECULAR_WEIGHT>
136.234

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1(C2CC3C1(C3C2)C)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1(C2CC3C1(C3C2)C)C

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
136.125

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
10

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
2

> <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>
2  12  3
3  11  3

$$$$
