Molecule FYI-1004502

A

Molecule Summary:

ID: FYI-1004502
Names:
InChIKey: PRAKJMSDJKAYCZ-UHFFFAOYSA-N
SMILES: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

Received at FYIcenter.com on: 2023-09-11

Molecule ID: FYI-1004502 Edit

Molecule Structure InChIKey: PRAKJMSDJKAYCZ-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1004502
FYIcenter.com

 30 29  0  0  0  0  0  0  0  0999 V2000
   27.8860    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8498    1.4000    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    1.4000    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
    1.2124    3.5000    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  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  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  7  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
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 21 20  1  0  0  0  0
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 23 22  1  0  0  0  0
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 25 23  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 28  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004502-3D
FYIcenter.com

 92 91  0  0  1  0  0  0  0  0999 V2000
    0.8639   -0.1580    0.0748 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3893   -0.1936    0.0457 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8828   -0.1714   -1.4049 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494    0.9721    0.8820 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0426    2.1315    1.7246 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.6160    3.2441    2.6860 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7180    4.3030    3.5762 C   0  0  3  0  0  0  0  0  0  0  0  0
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   11.2034    5.3627    4.5686 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7159    5.3940    4.6796 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1458    6.3953    5.7372 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.7584    7.5627    6.5847 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.6893    8.0510    5.0171 C   0  0  0  0  0  0  0  0  0  0  0  0
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   22.5609    4.2114    2.8799 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

✍: FYIcenter.com

2023-09-16, 1880👍, 0💬