Molecule Editor

Molecule ID: FYI-1002096 Edit

Molecule Structure InChIKey: QTBSBXVTEAMEQO-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1002096
FYIcenter.com

  4  3  0  0  0  0  0  0  0  0999 V2000
    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
    1.2124    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002096-3D
FYIcenter.com

  8  7  0     0  0  0  0  0  0999 V2000
   -0.3035    1.2890   -0.0002 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9800   -0.8878   -0.0002 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3743   -0.3516   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0907   -0.0496    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8368    0.0570   -0.9021 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8400    0.0676    0.8952 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5207   -1.4356    0.0064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2598    1.5081   -0.0008 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  8  1  0  0  0  0
  2  4  2  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
M  END
$$$$