Molecule FYI-1007398

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Molecule Summary:

ID: FYI-1007398
Names:
InChIKey: GKASDNZWUGIAMG-UHFFFAOYSA-N
SMILES: CCOC(OCC)OCC

Received at FYIcenter.com on: 2024-02-20

Molecule ID: FYI-1007398 Edit

Molecule Structure InChIKey: GKASDNZWUGIAMG-UHFFFAOYSA-N

Molecule Structure SMILES String: CCOC(OCC)OCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1007398
FYIcenter.com

 10  9  0  0  0  0  0  0  0  0999 V2000
    7.2747    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    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  3  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  4  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007398-3D
FYIcenter.com

 26 25  0     0  0  0  0  0  0999 V2000
   -0.8139    1.0378   -0.7281 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2543   -1.1145    0.1482 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4172    0.5496   -0.1083 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1883    0.0120   -0.6213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1921    1.5859    0.5281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4475   -1.6895   -0.3679 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4693   -0.4063   -0.1037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2452    2.6501    0.3048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8428   -2.8660    0.4988 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7210    0.2410    0.4494 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3826   -0.3267   -1.6464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5959    0.8067    1.1825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3210    2.0367    1.0158 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2632   -0.9595   -0.3716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2753   -2.0306   -1.3948 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2014   -1.2627    0.5242 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6541   -0.7572   -1.1249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5562    3.0979    1.2529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8630    3.4399   -0.3503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1244    2.2240   -0.1897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7555   -3.3384    0.1248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0426   -3.6133    0.5230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0094   -2.5443    1.5322 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5535   -0.4680    0.4658 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0069    1.1073   -0.1562 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5485    0.6071    1.4669 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
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  4 11  1  0  0  0  0
  5  8  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6  9  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  7 10  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
  9 23  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
 10 26  1  0  0  0  0
M  END
$$$$

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2024-02-28, 2012👍, 0💬