Molecule FYI-1000276

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A

Molecule Summary:

ID: FYI-1000276
SMILES: CC[C@H](C)O

Received at FYIcenter.com on: 2021-03-02

Molecule ID: FYI-1000276 Edit

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

Download SDF Download SVG Structure in 2D SDF:

FYI-1000276
FYIcenter.com

  5  4  0  0  1  0  0  0  0  0999 V2000
    3.6373    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
    1.2124    2.1000    0.0000 C   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  1  0  0  0  0
  4  3  1  0  0  0  0
  3  5  1  6  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1000276-3D
FYIcenter.com

 15 14  0  0  1  0  0  0  0  0999 V2000
    3.4191   -0.0484   -3.8046 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7832    0.4737   -2.5232 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0320   -0.4545   -1.3314 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3785    0.0776   -0.0631 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4312   -0.5942   -1.1010 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1677    0.6068   -4.6447 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0599   -1.0553   -4.0393 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5101   -0.0821   -3.7211 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7051    0.5943   -2.6805 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1992    1.4677   -2.3170 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6356   -1.4527   -1.5479 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7525    1.0777    0.1824 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6186   -0.5658    0.7900 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2906    0.1285   -0.1685 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7950    0.2909   -0.9267 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  7  1  0  0  0  0
  1  8  1  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
  3  5  1  0  0  0  0
  3  4  1  0  0  0  0
  3  2  1  0  0  0  0
  3 11  1  6  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5 15  1  0  0  0  0
M  END
$$$$

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2021-04-15, 2675👍, 0💬