Molecule Editor

Molecule ID: FYI-1003909 Edit

Molecule Structure InChIKey: NIXOWILDQLNWCW-UHFFFAOYSA-N

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

Download SDF Download SVG Structure in 2D SDF:

FYI-1003909
FYIcenter.com

  5  4  0  0  0  0  0  0  0  0999 V2000
    1.2125    3.5000    0.0000 O   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
    0.0000    1.4000    0.0000 O   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  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  3  5  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003909-3D
FYIcenter.com

  9  8  0     0  0  0  0  0  0999 V2000
   -1.5601   -0.8029   -0.0003 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6543    1.2846    0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7867   -0.5993    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5281    0.0687    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9558    0.0489   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7840   -1.6853    0.0016 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8883   -0.5054   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0117    1.1318   -0.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4282   -0.3460   -0.0007 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  9  1  0  0  0  0
  2  4  2  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  3  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
M  END
$$$$