Molecule FYI-1004173

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A

Molecule Summary:

ID: FYI-1004173
Names:
InChIKey: HKNNSWCACQFVIK-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C

Received at FYIcenter.com on: 2023-08-20

Molecule ID: FYI-1004173 Edit

Molecule Structure InChIKey: HKNNSWCACQFVIK-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1004173
FYIcenter.com

 22 21  0  0  0  0  0  0  0  0999 V2000
   21.8239    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6115    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3369    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.4000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    0.1876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    2.6124    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
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
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 13 12  1  0  0  0  0
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 17 16  2  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 19  1  0  0  0  0
 22 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004173-3D
FYIcenter.com

 62 61  0  0  0  0  0  0  0  0999 V2000
    1.0109   -0.0590    0.0962 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5285   -0.0581    0.0864 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0586   -0.5154   -1.2670 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5809   -0.5171   -1.2788 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0982   -0.9732   -2.6353 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6183   -0.9733   -2.6482 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1325   -1.4273   -4.0044 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6523   -1.4284   -4.0138 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1666   -1.8842   -5.3689 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6869   -1.8884   -5.3817 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1971   -2.3456   -6.7408 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7182   -2.3543   -6.7666 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2350   -2.8129   -8.1288 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7595   -2.8165   -8.1317 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3446   -3.2722   -9.4640 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8499   -3.2160   -9.3848 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.7967   -4.4265   -8.0259 Si  0  0  0  0  0  0  0  0  0  0  0  0
   18.5844   -3.4274   -6.4358 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2369   -6.1945   -7.5525 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2586   -3.7060   -8.9581 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9577    0.4894   -1.0585 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7210   -0.3077   -3.4215 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7254   -1.9807   -2.8575 H   0  0  0  0  0  0  0  0  0  0  0  0
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    6.9933    0.0337   -2.4271 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7555   -0.7597   -4.7890 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7577   -2.4338   -4.2277 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0290   -2.0951   -3.2284 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0267   -0.4216   -3.7920 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7892   -1.2166   -6.1533 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7894   -2.8901   -5.5905 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0633   -2.5558   -4.5963 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0632   -0.8820   -5.1592 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8162   -1.6765   -7.5218 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8162   -3.3507   -6.9586 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0955   -3.0206   -5.9806 H   0  0  0  0  0  0  0  0  0  0  0  0
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   15.1191   -3.4718   -7.3291 H   0  0  0  0  0  0  0  0  0  0  0  0
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   19.4959   -3.4670   -5.8344 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.4274   -6.6570   -6.9798 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.1434   -6.2103   -6.9398 H   0  0  0  0  0  0  0  0  0  0  0  0
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   20.4587   -4.2689   -9.8739 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1557   -3.7434   -8.3307 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 23  1  0  0  0  0
  1 24  1  0  0  0  0
  1 25  1  0  0  0  0
  2  3  1  0  0  0  0
  2 26  1  0  0  0  0
  2 27  1  0  0  0  0
  3  4  1  0  0  0  0
  3 28  1  0  0  0  0
  3 29  1  0  0  0  0
  4  5  1  0  0  0  0
  4 30  1  0  0  0  0
  4 31  1  0  0  0  0
  5  6  1  0  0  0  0
  5 32  1  0  0  0  0
  5 33  1  0  0  0  0
  6  7  1  0  0  0  0
  6 34  1  0  0  0  0
  6 35  1  0  0  0  0
  7  8  1  0  0  0  0
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 16 17  2  0  0  0  0
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 22 60  1  0  0  0  0
 22 61  1  0  0  0  0
 22 62  1  0  0  0  0
M  END
$$$$

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2023-08-25, 2745👍, 0💬