Molecule FYI-1006379

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Molecule Summary:

ID: FYI-1006379
Names:
InChIKey: UEBOXFBWXWTPKD-UHFFFAOYSA-N
SMILES: c2ccc1ccccc1c2

Received at FYIcenter.com on: 2023-12-13

Molecule ID: FYI-1006379 Edit

Molecule Structure InChIKey: UEBOXFBWXWTPKD-UHFFFAOYSA-N

Molecule Structure SMILES String: c2ccc1ccccc1c2

Download SDF Download SVG Structure in 2D SDF:

FYI-1006379
FYIcenter.com

 10 11  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    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
    1.2124    0.0000    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
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    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
    2.4249    2.1000    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  1  2  0  0  0  0
  3  2  2  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  8  1  0  0  0  0
  9  4  1  0  0  0  0
 10  9  2  0  0  0  0
 10  1  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006379-3D
FYIcenter.com

 18 19  0  0  0  0  0  0  0  0999 V2000
    2.4313   -0.6969   -0.0094 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4322    0.6947   -0.0037 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2235    1.3931    0.0066 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0018    0.7065    0.0051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2270    1.3941   -0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4361    0.6974   -0.0105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4371   -0.6947   -0.0053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2286   -1.3931    0.0041 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0029   -0.7076    0.0048 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2223   -1.3948   -0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3718   -1.2415   -0.0212 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3728    1.2388   -0.0095 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2439    2.4805    0.0119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2458    2.4815   -0.0041 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3759    1.2425   -0.0221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3780   -1.2384   -0.0114 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2495   -2.4804    0.0076 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2422   -2.4815   -0.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  2  0  0  0  0
  1 11  1  0  0  0  0
  2  3  2  0  0  0  0
  2 12  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  0  0  0  0
  5  6  2  0  0  0  0
  5 14  1  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  2  0  0  0  0
  7 16  1  0  0  0  0
  8  9  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  1  0  0  0  0
 10 18  1  0  0  0  0
M  END
$$$$

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2023-12-29, 268👍, 0💬