Molecule FYI-1011249

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Molecule Summary:

ID: FYI-1011249
Names: METHANESULFONIC ACID;
InChIKey: AFVFQIVMOAPDHO-UHFFFAOYSA-N
SMILES: CS(=O)(=O)O

Received at FYIcenter.com on: 2024-07-30

Molecule ID: FYI-1011249 Edit

Molecule Names: METHANESULFONIC ACID;

Molecule Structure InChIKey: AFVFQIVMOAPDHO-UHFFFAOYSA-N

Molecule Structure SMILES String: CS(=O)(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1011249
FYIcenter.com

  9  8  0     0  0  0  0  0  0999 V2000
    2.8660    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    0.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660   -0.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900    0.0369    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -0.8100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100   -1.0369    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690    0.1900    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  2  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1011249-3D
FYIcenter.com

  9  8  0     0  0  0  0  0  0999 V2000
    0.1511    0.0012    0.0816 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0190   -0.0035   -1.5428 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7217   -1.2585    0.5118 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6953    1.2747    0.5058 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5871   -0.0138    0.4436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0458    0.8782    0.0129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0284   -0.9195    0.0237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7074   -0.0087    1.5289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2922   -0.8503   -1.9411 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  2  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
M  END
$$$$

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2024-08-06, 1533👍, 0💬