Molecule FYI-1008077

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A

Molecule Summary:

ID: FYI-1008077
Names:
InChIKey: KWSDSCXAPPWVMQ-UHFFFAOYSA-N
SMILES: CCC1CC(C)CC(C)C1

Received at FYIcenter.com on: 2024-04-11

Molecule ID: FYI-1008077 Edit

Molecule Structure InChIKey: KWSDSCXAPPWVMQ-UHFFFAOYSA-N

Molecule Structure SMILES String: CCC1CC(C)CC(C)C1

Download SDF Download SVG Structure in 2D SDF:

FYI-1008077
FYIcenter.com

 10 10  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    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
    0.0000    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  2  8  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1008077-3D
FYIcenter.com

 30 30  0     1  0  0  0  0  0999 V2000
   -1.0194    0.4489    0.2484 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6844   -1.4332    0.3148 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4612    0.9843    0.3450 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6873   -0.9798   -0.2029 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0860    1.4266   -0.1731 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7817   -0.4468   -0.1070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3707    0.8900   -0.3119 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0079   -2.8421   -0.1802 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5484    1.9521   -0.1199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4923    0.0000    0.1868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0772    0.4595    1.3458 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6486   -1.4625    1.4121 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4405    1.0044    1.4428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7088   -1.0384   -1.2991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4370   -1.6863    0.1697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1443    2.4286    0.2101 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1115    1.5057   -1.2682 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7415   -0.7605    0.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9015   -0.4716   -1.1984 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3597    0.8887   -1.4084 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5750    1.9205    0.0035 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9723   -3.1799    0.2135 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2441   -3.5545    0.1489 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0568   -2.8791   -1.2738 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5259    1.6569    0.2758 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6190    1.9774   -1.2127 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3386    2.9684    0.2296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4639   -0.9929   -0.2709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4647   -0.1123    1.2754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4591    0.4422   -0.0770 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  7  1  0  0  0  0
  1 11  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  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  6  1  0  0  0  0
  3  9  1  0  0  0  0
  3 13  1  0  0  0  0
  4 14  1  0  0  0  0
  4 15  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  7 10  1  0  0  0  0
  7 20  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
  8 24  1  0  0  0  0
  9 25  1  0  0  0  0
  9 26  1  0  0  0  0
  9 27  1  0  0  0  0
 10 28  1  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
M  END
$$$$

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