Molecule FYI-1016031

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Molecule Summary:

ID: FYI-1016031
Names:
InChIKey: ZSFABVOIAIIPSQ-UHFFFAOYSA-N
SMILES: C#CC(CC)CCCC

Received at FYIcenter.com on: 2025-11-10

Molecule ID: FYI-1016031 Edit

Molecule Structure InChIKey: ZSFABVOIAIIPSQ-UHFFFAOYSA-N

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

Download SDF Download SVG Structure in 2D SDF:

FYI-1016031
FYIcenter.com

  9  8  0  0  0  0  0  0  0  0999 V2000
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  3  0  0  0  0
  6  3  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
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016031-3D
FYIcenter.com

 25 24  0     1  0  0  0  0  0999 V2000
    0.4178    0.7199   -0.3399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9520    0.3094    0.2408 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6273    0.0041    0.2759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0997    1.1825   -0.2959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9359    0.5118   -0.3334 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4423    0.8581    0.3505 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1428   -0.1678    0.2933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2104   -1.1255   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4195   -2.2925   -0.1909 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4180    0.5483   -1.4249 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5456    1.8010   -0.1972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9034    0.4617    1.3279 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5514   -1.0772    0.1146 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6354    0.1714    1.3597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8689    2.2385   -0.1095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1905    1.0627   -1.3827 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0195    1.5950   -0.1879 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9391    0.3280   -1.4141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3838    0.9413    1.4405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2042    1.5617   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7836   -0.1498    0.0966 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1071   -1.2509    0.1390 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1864    0.0249    1.3700 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0665    0.2093   -0.1569 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6049   -3.3274   -0.3600 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  4  1  0  0  0  0
  2  8  1  0  0  0  0
  2 12  1  0  0  0  0
  3  5  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  4  6  1  0  0  0  0
  4 15  1  0  0  0  0
  4 16  1  0  0  0  0
  5  7  1  0  0  0  0
  5 17  1  0  0  0  0
  5 18  1  0  0  0  0
  6 19  1  0  0  0  0
  6 20  1  0  0  0  0
  6 21  1  0  0  0  0
  7 22  1  0  0  0  0
  7 23  1  0  0  0  0
  7 24  1  0  0  0  0
  8  9  3  0  0  0  0
  9 25  1  0  0  0  0
M  END
$$$$

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