Molecule FYI-1006215

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A

Molecule Summary:

ID: FYI-1006215
Names:
InChIKey: WGYZNSLNBMFLHA-UHFFFAOYSA-N
SMILES: C=CC1=CCN(C)CO1

Received at FYIcenter.com on: 2023-12-03

Molecule ID: FYI-1006215 Edit

Molecule Structure InChIKey: WGYZNSLNBMFLHA-UHFFFAOYSA-N

Molecule Structure SMILES String: C=CC1=CCN(C)CO1

Download SDF Download SVG Structure in 2D SDF:

FYI-1006215
FYIcenter.com

  9  9  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 N   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    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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
  5  7  1  0  0  0  0
  2  8  1  0  0  0  0
  8  9  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006215-3D
FYIcenter.com

 20 20  0  0  0  0  0  0  0  0999 V2000
    1.2788   -0.4597    0.6456 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3532    0.0159    0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1459    1.1528    0.4239 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2016    1.5747   -0.2725 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0041    2.7499    0.1339 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6936    3.3248    1.4279 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8563    3.3885    2.3040 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5154    2.8176    2.1267 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7224    1.7703    1.5620 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7381   -1.3178    0.2609 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9129   -0.0086    1.5626 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6633   -0.4847   -0.9126 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4987    1.0744   -1.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8669    3.5312   -0.6236 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0616    2.4601    0.0697 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6951    3.8883    1.8058 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1851    2.3910    2.6173 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6352    3.9792    3.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8355    3.6640    2.2781 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7749    2.4696    3.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  3  4  2  0  0  0  0
  3  9  1  0  0  0  0
  4  5  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  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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2023-12-10, 1643👍, 0💬