Molecule FYI-1006192

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A

Molecule Summary:

ID: FYI-1006192
Names:
InChIKey: UJELIOPUVOHSEY-UHFFFAOYSA-N
SMILES: C1CCCCC1.c1ccccc1.Br

Received at FYIcenter.com on: 2023-11-30

Molecule ID: FYI-1006192 Edit

Molecule Structure InChIKey: UJELIOPUVOHSEY-UHFFFAOYSA-N

Molecule Structure SMILES String: C1CCCCC1.c1ccccc1.Br

Download SDF Download SVG Structure in 2D SDF:

FYI-1006192
FYIcenter.com

 13 12  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    1.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    6.1573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    7.3698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    7.3698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.1573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    4.9449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    4.9449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3200    3.6849    0.0000 Br  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
  6  1  1  0  0  0  0
  8  7  2  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 12  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006192-3D
FYIcenter.com

 32 31  0  0  0  0  0  0  0  0999 V2000
   -1.6574   -0.3162   -0.7744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1210   -2.0580   -0.7580 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7712   -2.3576   -0.5258 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1019   -1.2476    0.4775 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0078    0.6123    0.8634 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3052    1.4431    1.0148 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4452    0.2056   -0.8514 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1862   -0.6724    0.8935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4306   -0.2050    1.6065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1607    1.1046    1.1134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6935    1.9845   -0.1873 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4305    1.6385   -1.1878 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8218    0.6375   -3.4105 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.7754   -0.1403   -0.8231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6046   -0.1519   -1.9011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9719   -2.5555   -0.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5396   -2.5002    0.2295 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0523   -2.4039   -1.5787 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8569   -3.4440   -0.2010 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1702   -1.6265    0.4125 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1146   -1.5423    1.5609 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3757    1.0839   -0.0709 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9024    1.2847    0.8926 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3668    2.5625    1.0054 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1646    1.3826    2.1315 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2707   -0.0689   -1.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0956   -1.5522    1.4587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7724   -0.9161    2.3063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0491    1.2079    1.6661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2891    2.9068   -0.3105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1160    2.3321   -1.9729 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3685    0.3078   -2.0073 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 18  1  0  0  0  0
  3 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4 20  1  0  0  0  0
  4 21  1  0  0  0  0
  5  6  1  0  0  0  0
  5 22  1  0  0  0  0
  5 23  1  0  0  0  0
  6 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  2  0  0  0  0
  7 26  1  0  0  0  0
  8  9  2  0  0  0  0
  8 27  1  0  0  0  0
  9 10  1  0  0  0  0
  9 28  1  0  0  0  0
 10 11  2  0  0  0  0
 10 29  1  0  0  0  0
 11 12  1  0  0  0  0
 11 30  1  0  0  0  0
 12 31  1  0  0  0  0
 13 32  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-12-10, 379👍, 0💬