Molecule FYI-1007200

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Molecule Summary:

ID: FYI-1007200
Names:
InChIKey: RPMUDXVQHUECRE-UHFFFAOYSA-N
SMILES: CC1COC(C)OC1

Received at FYIcenter.com on: 2024-02-07

Molecule ID: FYI-1007200 Edit

Molecule Structure InChIKey: RPMUDXVQHUECRE-UHFFFAOYSA-N

Molecule Structure SMILES String: CC1COC(C)OC1

Download SDF Download SVG Structure in 2D SDF:

FYI-1007200
FYIcenter.com

  8  8  0  0  0  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
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    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
    1.2124    0.7000    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
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    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
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  1  8  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007200-3D
FYIcenter.com

 20 20  0     0  0  0  0  0  0999 V2000
    0.7222   -1.1876   -0.1760 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7224    1.1877   -0.1758 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3847    0.0001   -0.3323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6606   -1.2498    0.1739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6606    1.2497    0.1737 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3267   -0.0001    0.3417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8520    0.0001    0.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7865    0.0000   -0.0788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3128   -0.0001   -1.4282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7511   -1.3588    1.2615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0815   -2.1503   -0.2856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0814    2.1502   -0.2858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7512    1.3588    1.2613 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2702   -0.0002    1.4382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3632   -0.8852   -0.3188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9635    0.0001    1.1632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3633    0.8852   -0.3189 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3009    0.8928    0.2904 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3010   -0.8929    0.2901 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8728    0.0002   -1.1714 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6  8  1  0  0  0  0
  6 14  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
M  END
$$$$

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2024-02-18, 1297👍, 0💬