Molecule FYI-1001357

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A

Molecule Summary:

ID: FYI-1001357
SMILES: C1C[C@@H](C)[C@@H](C)[CH]C1

Received at FYIcenter.com on: 2022-06-07

Molecule ID: FYI-1001357 Edit

Molecule Structure SMILES String: C1C[C@@H](C)[C@@H](C)[CH]C1

Download SDF Download SVG Structure in 2D SDF:

FYI-1001357
FYIcenter.com

  8  8  0  0  1  0  0  0  0  0999 V2000
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    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    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    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
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   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
  3  4  1  6  0  0  0
  5  3  1  0  0  0  0
  5  6  1  6  0  0  0
  7  5  1  0  0  0  0
  8  7  1  0  0  0  0
  8  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001357-3D
FYIcenter.com

 23 23  0  0  1  0  0  0  0  0999 V2000
    0.7328    1.2781   -0.2728 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4684    0.0243    0.2041 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6947   -1.2541   -0.1643 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4741   -2.5000    0.2595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7519   -1.2342    0.3858 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8557   -1.4047    1.9052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4314    0.0461   -0.0187 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.7129    1.3366    0.2129 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7456    1.3029   -1.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2698    2.1712    0.0676 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6254    0.0782    1.2875 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4639    0.0012   -0.2562 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6260   -1.2853   -1.2619 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6508   -2.5253    1.3395 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4523   -2.5272   -0.2332 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9341   -3.4094   -0.0234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3021   -2.0612   -0.0783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2942   -0.6367    2.4475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4809   -2.3833    2.2215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8999   -1.3408    2.2319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5111    0.0560   -0.1287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7389    1.5705    1.2835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2399    2.1461   -0.3036 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 13  1  6  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 17  1  6  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  6 20  1  0  0  0  0
  7  8  1  0  0  0  0
  7 21  1  0  0  0  0
  8 22  1  0  0  0  0
  8 23  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2022-07-26, 1616👍, 0💬