97829
  DSViewer          3D                             0

 39 41  0  0  0  0  0  0  0  0999 V2000
    3.5135   -0.0440    0.2564 C   0  0  3  0  0  0  0  0  0  1
    2.2681    0.7504    0.0957 C   0  0  3  0  0  0  0  0  0  2
    4.8587    0.7381   -0.0520 C   0  0  3  0  0  0  0  0  0  3
    2.9614    0.2881    1.5620 C   0  0  0  0  0  0  0  0  0  4
    3.4930   -1.5940   -0.1554 C   0  0  0  0  0  0  0  0  0  5
    6.0124   -0.0456    0.6190 C   0  0  0  0  0  0  0  0  0  6
    4.7225   -2.2454    0.5302 C   0  0  0  0  0  0  0  0  0  7
    4.7656    2.1481    0.5863 C   0  0  0  0  0  0  0  0  0  8
    2.3912    2.2480   -0.1270 C   0  0  0  0  0  0  0  0  0  9
    6.0418   -1.5184    0.0895 C   0  0  0  0  0  0  0  0  0 10
    5.1825    0.9247   -1.5733 C   0  0  0  0  0  0  0  0  0 11
    3.5538   -1.8701   -1.6846 C   0  0  0  0  0  0  0  0  0 12
    2.2087   -2.2815    0.3585 C   0  0  0  0  0  0  0  0  0 13
    3.5447    2.8884    0.0980 C   0  0  0  0  0  0  0  0  0 14
    1.2051    3.0175   -0.6263 C   0  0  0  0  0  0  0  0  0 15
    1.2837    0.2716    0.0235 H   0  0  0  0  0  0  0  0  0 16
    2.4951   -0.4794    2.1798 H   0  0  0  0  0  0  0  0  0 17
    3.4503    1.0227    2.2017 H   0  0  0  0  0  0  0  0  0 18
    6.9604    0.4398    0.3869 H   0  0  0  0  0  0  0  0  0 19
    5.8624   -0.0537    1.6986 H   0  0  0  0  0  0  0  0  0 20
    4.6137   -2.1679    1.6119 H   0  0  0  0  0  0  0  0  0 21
    4.7786   -3.2958    0.2445 H   0  0  0  0  0  0  0  0  0 22
    4.7089    2.0447    1.6699 H   0  0  0  0  0  0  0  0  0 23
    5.6564    2.7177    0.3213 H   0  0  0  0  0  0  0  0  0 24
    6.1109   -1.5143   -0.9983 H   0  0  0  0  0  0  0  0  0 25
    6.9032   -2.0396    0.5069 H   0  0  0  0  0  0  0  0  0 26
    6.1201    1.4699   -1.6815 H   0  0  0  0  0  0  0  0  0 27
    4.3791    1.4863   -2.0500 H   0  0  0  0  0  0  0  0  0 28
    5.2739   -0.0521   -2.0483 H   0  0  0  0  0  0  0  0  0 29
    2.2168   -3.3318    0.0674 H   0  0  0  0  0  0  0  0  0 30
    1.3360   -1.7919   -0.0738 H   0  0  0  0  0  0  0  0  0 31
    2.1658   -2.2065    1.4451 H   0  0  0  0  0  0  0  0  0 32
    3.5348   -2.9455   -1.8612 H   0  0  0  0  0  0  0  0  0 33
    4.4734   -1.4515   -2.0936 H   0  0  0  0  0  0  0  0  0 34
    2.6959   -1.4071   -2.1723 H   0  0  0  0  0  0  0  0  0 35
    3.6032    3.9631   -0.0744 H   0  0  0  0  0  0  0  0  0 36
    1.4705    4.0697   -0.7277 H   0  0  0  0  0  0  0  0  0 37
    0.3823    2.9174    0.0816 H   0  0  0  0  0  0  0  0  0 38
    0.8991    2.6254   -1.5962 H   0  0  0  0  0  0  0  0  0 39
  1  2  1  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  1  5  1  0  0  0
  2  4  1  0  0  0
  2  9  1  0  0  0
  2 16  1  0  0  0
  3  6  1  0  0  0
  3  8  1  0  0  0
  3 11  1  0  0  0
  4 17  1  0  0  0
  4 18  1  0  0  0
  5  7  1  0  0  0
  5 12  1  0  0  0
  5 13  1  0  0  0
  6 10  1  0  0  0
  6 19  1  0  0  0
  6 20  1  0  0  0
  7 10  1  0  0  0
  7 21  1  0  0  0
  7 22  1  0  0  0
  8 14  1  0  0  0
  8 23  1  0  0  0
  8 24  1  0  0  0
  9 14  2  0  0  0
  9 15  1  0  0  0
 10 25  1  0  0  0
 10 26  1  0  0  0
 11 27  1  0  0  0
 11 28  1  0  0  0
 11 29  1  0  0  0
 12 33  1  0  0  0
 12 34  1  0  0  0
 12 35  1  0  0  0
 13 30  1  0  0  0
 13 31  1  0  0  0
 13 32  1  0  0  0
 14 36  1  0  0  0
 15 37  1  0  0  0
 15 38  1  0  0  0
 15 39  1  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
97829

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
336

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBwAAAAAAAAAAAAAAAAGAAAAAAAAAAwQAAABAAAAACAAAAAGAAAAAAADwCAAAACAAAAAACAAiBCAAAAAAAgAAAACAAAAAgAAAIAAQAAAAAAgAAIAAMAgMAPgAAAAAAAAAAAAAQAACAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
2,4a,8,8-tetramethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene

> <PUBCHEM_IUPAC_CAS_NAME>
2,4a,8,8-tetramethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene

> <PUBCHEM_IUPAC_NAME>
2,4a,8,8-tetramethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
2,4a,8,8-tetramethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
2,4a,8,8-tetramethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C15H24/c1-11-6-9-14(4)8-5-7-13(2,3)15(14)10-12(11)15/h6,12H,5,7-10H2,1-4H3

> <PUBCHEM_IUPAC_INCHIKEY>
WXQGPFZDVCRBME-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
4.8

> <PUBCHEM_EXACT_MASS>
204.188

> <PUBCHEM_MOLECULAR_FORMULA>
C15H24

> <PUBCHEM_MOLECULAR_WEIGHT>
204.351

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=CCC2(CCCC(C23C1C3)(C)C)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1=CCC2(CCCC(C23C1C3)(C)C)C

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
204.188

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
15

> <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>
1  4  3
2  16  3
3  11  3

$$$$
