Molecule FYI-1014552

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A

Molecule Summary:

ID: FYI-1014552
Names:
InChIKey: OWJCKBJBQIKWGJ-UHFFFAOYSA-N
SMILES: c1ccccc1.C1CCCC1

Received at FYIcenter.com on: 2025-04-27

Molecule ID: FYI-1014552 Edit

Molecule Structure InChIKey: OWJCKBJBQIKWGJ-UHFFFAOYSA-N

Molecule Structure SMILES String: c1ccccc1.C1CCCC1

Download SDF Download SVG Structure in 2D SDF:

FYI-1014552
FYIcenter.com

 11 11  0  0  0  0  0  0  0  0999 V2000
    5.6127    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4002    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4002    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6127    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8251    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8251    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8326   10.9890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2652   12.3205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326   13.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   12.3205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4326   10.9890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014552-3D
FYIcenter.com

 27 27  0  0  0  0  0  0  0  0999 V2000
    1.8198   -0.6723   -1.8972 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8772   -1.6986   -1.9613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4612   -1.4029   -2.2281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8536   -0.0829   -2.4463 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0951    0.9391   -2.4149 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4300    0.6459   -2.1309 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7781    0.1911    1.7478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1015   -1.0215    1.4959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5173   -0.5463    1.7878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4887    0.9789    1.6979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0784    1.3454    1.2601 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8511   -0.8966   -1.6383 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1748   -2.7226   -1.7515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2032   -2.1969   -2.2259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9006    0.1524   -2.6168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2135    1.9706   -2.5638 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1584    1.4491   -2.0581 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7359    0.1312    1.2222 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9803    0.2947    2.8201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0368   -1.3226    0.4571 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1865   -1.8877    2.0990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8308   -0.8578    2.7907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2270   -0.9778    1.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6985    1.4099    2.6826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2428    1.3678    1.0044 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2512    2.3091    1.6553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0440    1.4129    0.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  9 10  1  0  0  0  0
  9 22  1  0  0  0  0
  9 23  1  0  0  0  0
 10 11  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
 11 26  1  0  0  0  0
 11 27  1  0  0  0  0
M  END
$$$$

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2025-05-12, 1276👍, 0💬