Molecule Editor

Molecule ID: FYI-1002763 Edit

Molecule Names: DECANE;

Molecule Structure InChIKey: DIOQZVSQGTUSAI-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1002763
FYIcenter.com

 10  9  0  0  0  0  0  0  0  0999 V2000
   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
    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    0.7000    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
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002763-3D
FYIcenter.com

 32 31  0     0  0  0  0  0  0999 V2000
    0.6609    0.3879    0.0661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6429   -0.4161    0.0972 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9141   -0.4894    0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8962    0.4625    0.0635 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1858    0.3618    0.0071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1992   -0.3430    0.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4381   -0.5110   -0.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4498    0.5305   -0.0748 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7050    0.3295   -0.0568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7158   -0.3129   -0.0870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6545    1.0461   -0.8116 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7003    1.0379    0.9490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6618   -1.0407    0.9986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6616   -1.0985   -0.7616 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9262   -1.1540    0.8964 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8837   -1.1263   -0.8682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8990    1.1243    0.9383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8564    1.1084   -0.8224 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1609    1.0455   -0.8503 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2247    0.9800    0.9123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1721   -1.0374   -0.8149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2602   -0.9559    0.9421 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4602   -1.2094    0.7711 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4154   -1.1111   -0.9905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4887    1.2289    0.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4052    1.1299   -0.9913 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5879   -0.3145   -0.1162 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7742    0.9167    0.8645 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7294    1.0190   -0.9067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5982    0.3299   -0.1655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7202   -1.0015   -0.9379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8044   -0.9008    0.8320 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  4  1  0  0  0  0
  2 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3  5  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  4  6  1  0  0  0  0
  4 17  1  0  0  0  0
  4 18  1  0  0  0  0
  5  7  1  0  0  0  0
  5 19  1  0  0  0  0
  5 20  1  0  0  0  0
  6  8  1  0  0  0  0
  6 21  1  0  0  0  0
  6 22  1  0  0  0  0
  7  9  1  0  0  0  0
  7 23  1  0  0  0  0
  7 24  1  0  0  0  0
  8 10  1  0  0  0  0
  8 25  1  0  0  0  0
  8 26  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
  9 29  1  0  0  0  0
 10 30  1  0  0  0  0
 10 31  1  0  0  0  0
 10 32  1  0  0  0  0
M  END
$$$$