5281519
  DSViewer          3D                             0

 39 39  0  0  0  0  0  0  0  0999 V2000
    5.8786   -1.1213    0.0831 C   0  0  0  0  0  0  0  0  0  1
    5.9050    0.5138    0.3032 C   0  0  0  0  0  0  0  0  0  2
    4.6752   -2.1204    0.4872 C   0  0  0  0  0  0  0  0  0  3
    4.7203    1.5258    0.6937 C   0  0  0  0  0  0  0  0  0  4
    3.4565   -1.8903   -0.3557 C   0  0  0  0  0  0  0  0  0  5
    0.9299    0.4471    0.3194 C   0  0  0  0  0  0  0  0  0  6
    1.1703   -1.0224   -0.3705 C   0  0  0  0  0  0  0  0  0  7
    2.1926    1.4206    0.4310 C   0  0  0  0  0  0  0  0  0  8
    7.0976    1.0894    0.1070 C   0  0  0  0  0  0  0  0  0  9
    3.4101    0.9062    0.6141 C   0  0  0  0  0  0  0  0  0 10
    2.3023   -1.7367    0.3073 C   0  0  0  0  0  0  0  0  0 11
    3.5985   -1.4638   -1.8095 C   0  0  0  0  0  0  0  0  0 12
    2.0115    2.9047    0.3103 C   0  0  0  0  0  0  0  0  0 13
    8.2893    0.2551   -0.2791 C   0  0  0  0  0  0  0  0  0 14
    7.2607    2.5781    0.2633 C   0  0  0  0  0  0  0  0  0 15
    6.0212   -1.2665   -0.9878 H   0  0  0  0  0  0  0  0  0 16
    6.7506   -1.4946    0.6201 H   0  0  0  0  0  0  0  0  0 17
    5.0094   -3.1490    0.3514 H   0  0  0  0  0  0  0  0  0 18
    4.4168   -1.9570    1.5335 H   0  0  0  0  0  0  0  0  0 19
    4.8805    1.8740    1.7141 H   0  0  0  0  0  0  0  0  0 20
    4.7471    2.3750    0.0110 H   0  0  0  0  0  0  0  0  0 21
    0.1696    0.9633   -0.2668 H   0  0  0  0  0  0  0  0  0 22
    0.5573    0.2773    1.3296 H   0  0  0  0  0  0  0  0  0 23
    0.2618   -1.6171   -0.2755 H   0  0  0  0  0  0  0  0  0 24
    1.4094   -0.8895   -1.4256 H   0  0  0  0  0  0  0  0  0 25
    3.4232   -0.1781    0.7239 H   0  0  0  0  0  0  0  0  0 26
    2.1879   -2.1233    1.3200 H   0  0  0  0  0  0  0  0  0 27
    2.6095   -1.3474   -2.2528 H   0  0  0  0  0  0  0  0  0 28
    4.1551   -2.2232   -2.3588 H   0  0  0  0  0  0  0  0  0 29
    4.1326   -0.5149   -1.8598 H   0  0  0  0  0  0  0  0  0 30
    2.9778    3.3986    0.4119 H   0  0  0  0  0  0  0  0  0 31
    1.3409    3.2544    1.0953 H   0  0  0  0  0  0  0  0  0 32
    1.5839    3.1409   -0.6642 H   0  0  0  0  0  0  0  0  0 33
    9.1621    0.8980   -0.3927 H   0  0  0  0  0  0  0  0  0 34
    8.0876   -0.2529   -1.2222 H   0  0  0  0  0  0  0  0  0 35
    8.4824   -0.4849    0.4976 H   0  0  0  0  0  0  0  0  0 36
    8.2962    2.8536    0.0639 H   0  0  0  0  0  0  0  0  0 37
    6.9975    2.8681    1.2805 H   0  0  0  0  0  0  0  0  0 38
    6.6065    3.0917   -0.4413 H   0  0  0  0  0  0  0  0  0 39
  1  2  1  0  0  0
  1  3  1  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  2  4  1  0  0  0
  2  9  2  0  0  0
  3  5  1  0  0  0
  3 18  1  0  0  0
  3 19  1  0  0  0
  4 10  1  0  0  0
  4 20  1  0  0  0
  4 21  1  0  0  0
  5 11  2  0  0  0
  5 12  1  0  0  0
  6  7  1  0  0  0
  6  8  1  0  0  0
  6 22  1  0  0  0
  6 23  1  0  0  0
  7 11  1  0  0  0
  7 24  1  0  0  0
  7 25  1  0  0  0
  8 10  2  0  0  0
  8 13  1  0  0  0
  9 14  1  0  0  0
  9 15  1  0  0  0
 10 26  1  0  0  0
 11 27  1  0  0  0
 12 28  1  0  0  0
 12 29  1  0  0  0
 12 30  1  0  0  0
 13 31  1  0  0  0
 13 32  1  0  0  0
 13 33  1  0  0  0
 14 34  1  0  0  0
 14 35  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>
5281519

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
296

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAGAAAAAAADACAAAACAAAAAACAAiBCAAAAAAAgAAAACAAAAAgAAAIAAQAAAAAAgAAIAAMAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
(1E,5E)-8-isopropylidene-1,5-dimethyl-cyclodeca-1,5-diene

> <PUBCHEM_IUPAC_CAS_NAME>
(1E,5E)-1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene

> <PUBCHEM_IUPAC_NAME>
(1E,5E)-1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
(1E,5E)-1,5-dimethyl-8-propan-2-ylidene-cyclodeca-1,5-diene

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
(1E,5E)-8-isopropylidene-1,5-dimethyl-cyclodeca-1,5-diene

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6+,14-9+

> <PUBCHEM_IUPAC_INCHIKEY>
GXEGJTGWYVZSNR-SJRHNVSNSA-N

> <PUBCHEM_XLOGP3_AA>
4.1

> <PUBCHEM_EXACT_MASS>
204.188

> <PUBCHEM_MOLECULAR_FORMULA>
C15H24

> <PUBCHEM_MOLECULAR_WEIGHT>
204.351

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=CCCC(=CCC(=C(C)C)CC1)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
C/C/1=C\CC/C(=C/CC(=C(C)C)CC1)/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>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
2

> <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

$$$$
