Molecule Editor

Molecule ID: FYI-1002954 Edit

Molecule Structure InChIKey: MKUWVMRNQOOSAT-SCSAIBSYSA-N

Molecule Structure SMILES String: C=C[C@@H](C)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1002954
FYIcenter.com

  5  4  0  0  0  0  0  0  0  0999 V2000
    0.0000    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
    1.2124    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 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  4  2  1  1  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002954-3D
FYIcenter.com

 13 12  0     1  0  0  0  0  0999 V2000
   -1.1018   -1.2384   -0.0496 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4516   -0.0247    0.3185 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.3492    1.1515   -0.0426 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8544    0.0423   -0.4148 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0482    0.0693    0.1885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3034   -0.0422    1.4042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3090    1.0693    0.4792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8874    2.1069    0.2267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5780    1.1626   -1.1146 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8231    0.0580   -1.5016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5360   -1.9760    0.2369 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9593    0.1120   -0.3982 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1385    0.0496    1.2689 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
M  END
$$$$