Molecule Editor

Molecule ID: FYI-1015361 Edit

Molecule Structure InChIKey: KWOQMARCKSGDGU-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCC(CCC)CCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1015361
FYIcenter.com

 20 19  0  0  0  0  0  0  0  0999 V2000
   19.3990    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 14  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015361-3D
FYIcenter.com

 62 61  0  0  0  0  0  0  0  0999 V2000
    0.9287   -0.3027   -0.5335 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4463   -0.2675   -0.4832 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9857    0.9880   -1.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5103    1.0294   -1.1111 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0274    2.2886   -1.7956 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5494    2.3529   -1.7626 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0267    3.6245   -2.4520 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5435    3.7234   -2.4344 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0009    5.0004   -3.1336 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5172    5.0830   -3.1071 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0407    6.3373   -3.7984 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5675    6.2989   -3.7638 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1989    7.5302   -4.4058 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7467    7.5483   -4.2847 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3752    6.2962   -4.9479 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8995    6.1593   -4.8551 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4169    6.0563   -3.4291 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3116    8.8480   -4.9035 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8357   10.1287   -4.2103 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4327   11.3630   -4.8675 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5541   -1.2067   -0.0445 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5722   -0.3007   -1.5685 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5009    0.5654   -0.0217 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8473   -1.1592   -0.9785 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7762   -0.2986    0.5615 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5785    1.8787   -0.6658 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6509    1.0181   -2.2043 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9234    0.1423   -1.6064 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8505    1.0084   -0.0688 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6124    3.1749   -1.2998 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6826    2.3109   -2.8368 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9719    1.4742   -2.2647 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9024    2.3352   -0.7243 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5970    4.5004   -1.9502 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6703    3.6379   -3.4894 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9790    2.8490   -2.9338 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9049    3.7162   -1.3986 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5688    5.8758   -2.6345 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6439    5.0054   -4.1705 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9362    4.1940   -3.5957 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8651    5.0700   -2.0664 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6653    7.2335   -3.2936 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6898    6.3720   -4.8367 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8903    5.3930   -4.2862 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9076    6.2189   -2.7242 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7762    8.4065   -3.9048 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9045    7.5917   -5.4602 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9918    7.5391   -3.2162 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0922    6.2760   -6.0084 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9569    5.3887   -4.4999 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.3965    6.9888   -5.3690 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1948    5.2510   -5.3936 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1637    6.9412   -2.8384 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.5078    5.9623   -3.4337 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.0068    5.1743   -2.9272 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0476    8.8871   -5.9680 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4051    8.8347   -4.8492 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1203   10.1041   -3.1523 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7471   10.2216   -4.2554 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.5256   11.3421   -4.8278 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0876   12.2667   -4.3557 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1255   11.4294   -5.9164 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  1 23  1  0  0  0  0
  2  3  1  0  0  0  0
  2 24  1  0  0  0  0
  2 25  1  0  0  0  0
  3  4  1  0  0  0  0
  3 26  1  0  0  0  0
  3 27  1  0  0  0  0
  4  5  1  0  0  0  0
  4 28  1  0  0  0  0
  4 29  1  0  0  0  0
  5  6  1  0  0  0  0
  5 30  1  0  0  0  0
  5 31  1  0  0  0  0
  6  7  1  0  0  0  0
  6 32  1  0  0  0  0
  6 33  1  0  0  0  0
  7  8  1  0  0  0  0
  7 34  1  0  0  0  0
  7 35  1  0  0  0  0
  8  9  1  0  0  0  0
  8 36  1  0  0  0  0
  8 37  1  0  0  0  0
  9 10  1  0  0  0  0
  9 38  1  0  0  0  0
  9 39  1  0  0  0  0
 10 11  1  0  0  0  0
 10 40  1  0  0  0  0
 10 41  1  0  0  0  0
 11 12  1  0  0  0  0
 11 42  1  0  0  0  0
 11 43  1  0  0  0  0
 12 13  1  0  0  0  0
 12 44  1  0  0  0  0
 12 45  1  0  0  0  0
 13 14  1  0  0  0  0
 13 46  1  0  0  0  0
 13 47  1  0  0  0  0
 14 15  1  0  0  0  0
 14 18  1  0  0  0  0
 14 48  1  0  0  0  0
 15 16  1  0  0  0  0
 15 49  1  0  0  0  0
 15 50  1  0  0  0  0
 16 17  1  0  0  0  0
 16 51  1  0  0  0  0
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 17 53  1  0  0  0  0
 17 54  1  0  0  0  0
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 18 19  1  0  0  0  0
 18 56  1  0  0  0  0
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 19 20  1  0  0  0  0
 19 58  1  0  0  0  0
 19 59  1  0  0  0  0
 20 60  1  0  0  0  0
 20 61  1  0  0  0  0
 20 62  1  0  0  0  0
M  END
$$$$