Molecule Editor

Molecule ID: FYI-1016634 Edit

Molecule Structure InChIKey: NIDGCIPAMWNKOA-UHFFFAOYSA-N

Molecule Structure SMILES String: C=CC(=C)CCCC(C)CCCC(C)CCCC(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1016634
FYIcenter.com

 20 19  0  0  0  0  0  0  0  0999 V2000
   18.1865    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    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    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    1.4000    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    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    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
    2.4249    1.4000    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    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    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  2  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  7  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 12  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 17  2  0  0  0  0
 19 17  1  0  0  0  0
 20 19  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016634-3D
FYIcenter.com

 58 57  0     1  0  0  0  0  0999 V2000
   -1.7650    1.4405   -0.5905 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3127    2.8298   -0.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0550    3.4091   -0.7471 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7419    2.2977    0.7793 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2062    2.5408   -0.6477 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9485    0.9553    0.2768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4458   -0.4486   -0.0871 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0172    1.4251    0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6328   -0.8586    0.7919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1300    1.4744   -2.0774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1932   -2.2530    0.4554 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0478    3.6182    1.4957 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8106    0.0419    0.1392 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0905   -0.8053    0.2299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6923   -2.3508   -0.9870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3306   -2.6010    1.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0309   -2.2163   -0.3328 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2247   -3.0520   -0.2147 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9431   -2.7346   -0.9308 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3932   -2.7126    0.3444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9441    0.7266   -0.4538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1321    3.5464   -0.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1443    2.7816    0.9962 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1402    4.4000   -0.3215 H   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0036    1.5904   -1.1492 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9941    3.0275   -1.2379 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7615   -0.4590   -1.1329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6311   -1.1735    0.0227 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8176    1.9507    0.2334 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3647    1.2937    1.8030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4312   -0.1116    0.6927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3174   -0.8430    1.8430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3601    0.4756   -2.4592 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2993    1.8444   -2.6853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9963    2.1194   -2.2579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3957   -2.9941    0.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1367    4.1971    1.6738 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5027    3.4328    2.4750 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7403    4.2353    0.9135 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9845   -0.4671    0.6503 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5411    0.1482   -0.9165 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8938   -0.2607   -0.2844 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3696   -0.8703    1.2901 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1823   -3.3148   -1.1632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8681   -2.2782   -1.7027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4151   -1.5595   -1.2123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9837   -2.5709    2.4574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7109   -3.6096    1.2249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1654   -1.8988    1.3195 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1533   -4.0581   -0.6257 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0237   -2.1741   -1.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9344   -3.7479   -1.3223 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2085   -3.4286    0.3699 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5777   -1.7392    0.7835 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  1 10  1  0  0  0  0
  1 21  1  0  0  0  0
  2  3  1  0  0  0  0
  2 22  1  0  0  0  0
  2 23  1  0  0  0  0
  3  5  1  0  0  0  0
  3 24  1  0  0  0  0
  3 25  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  4 12  1  0  0  0  0
  4 26  1  0  0  0  0
  5 27  1  0  0  0  0
  5 28  1  0  0  0  0
  6  7  1  0  0  0  0
  6 29  1  0  0  0  0
  6 30  1  0  0  0  0
  7  9  1  0  0  0  0
  7 31  1  0  0  0  0
  7 32  1  0  0  0  0
  8 13  1  0  0  0  0
  8 33  1  0  0  0  0
  8 34  1  0  0  0  0
  9 11  1  0  0  0  0
  9 35  1  0  0  0  0
  9 36  1  0  0  0  0
 10 37  1  0  0  0  0
 10 38  1  0  0  0  0
 10 39  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  1  0  0  0  0
 11 40  1  0  0  0  0
 12 41  1  0  0  0  0
 12 42  1  0  0  0  0
 12 43  1  0  0  0  0
 13 14  1  0  0  0  0
 13 44  1  0  0  0  0
 13 45  1  0  0  0  0
 14 17  1  0  0  0  0
 14 46  1  0  0  0  0
 14 47  1  0  0  0  0
 15 48  1  0  0  0  0
 15 49  1  0  0  0  0
 15 50  1  0  0  0  0
 16 51  1  0  0  0  0
 16 52  1  0  0  0  0
 16 53  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 18 54  1  0  0  0  0
 19 55  1  0  0  0  0
 19 56  1  0  0  0  0
 20 57  1  0  0  0  0
 20 58  1  0  0  0  0
M  END
$$$$