Molecule FYI-1014870

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A

Molecule Summary:

ID: FYI-1014870
Names:
InChIKey: ZBEDLGKSWBORBS-UHFFFAOYSA-N
SMILES: OB1OCCO1

Received at FYIcenter.com on: 2025-06-02

Molecule ID: FYI-1014870 Edit

Molecule Structure InChIKey: ZBEDLGKSWBORBS-UHFFFAOYSA-N

Molecule Structure SMILES String: OB1OCCO1

Download SDF Download SVG Structure in 2D SDF:

FYI-1014870
FYIcenter.com

 11 11  0  0  0  0  0  0  0  0999 V2000
    2.4249    3.0757    0.0000 B   0  0  0  0  0  0  0  0  0  0  0  0
    2.5712    1.6834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9406    1.3923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6407    2.6048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7039    3.6452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.7757    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7943    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0733    0.5694    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9196    2.0353    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7733    3.4277    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.0757    0.0000 H   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
  1  6  1  0  0  0  0
  5  1  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  6 11  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014870-3D
FYIcenter.com

 11 11  0  0  0  0  0  0  0  0999 V2000
    1.2358    0.0492   -0.2061 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6797   -0.0189    0.0064 B   0  0  0  0  0  0  0  0  0  0  0  0
    3.4216   -1.1616   -0.5325 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7014   -0.6066   -0.6391 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4952    0.8868   -0.8208 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4533    1.2284    0.0448 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8601   -0.5997    0.4386 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2710   -1.0365   -1.4910 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2509   -0.8076    0.3099 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1799    1.1156   -1.8670 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4299    1.4459   -0.5952 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
M  END
$$$$

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2025-06-21, 708👍, 0💬