Molecule FYI-1005306

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A

Molecule Summary:

ID: FYI-1005306
Names:
InChIKey: OMKZWUPRGQMQJC-UHFFFAOYSA-N
SMILES: CN(C)CCCNCCCN

Received at FYIcenter.com on: 2023-10-23

Molecule ID: FYI-1005306 Edit

Molecule Structure InChIKey: OMKZWUPRGQMQJC-UHFFFAOYSA-N

Molecule Structure SMILES String: CN(C)CCCNCCCN

Download SDF Download SVG Structure in 2D SDF:

FYI-1005306
FYIcenter.com

 11 10  0  0  0  0  0  0  0  0999 V2000
   10.9119    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.0000    0.0000 C   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
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    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  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11  9  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005306-3D
FYIcenter.com

 32 31  0     0  0  0  0  0  0999 V2000
   -0.8558    0.6378    0.2618 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3122   -0.5033   -0.1437 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6974   -0.2817    0.2098 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5364    1.1577    0.3301 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4357    0.3308   -0.3366 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9223    0.8963   -0.2636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9185   -0.1360   -0.3684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2896    0.1762    0.2353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4196   -0.6379   -0.3973 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3697   -0.9037    1.2634 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6046   -0.7361   -0.7907 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3101    2.2231    0.1846 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5330    1.0086    1.4162 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6463   -0.7388   -0.2249 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4176    0.5595   -1.4091 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6517    1.5559    0.2247 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8974    1.1813   -1.3233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9511    0.0839   -1.4426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7178   -1.2087   -0.2561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8313    0.4386    1.2614 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5001    1.2473    0.1151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2613   -0.0210    1.3153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2362   -1.7090   -0.2603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4669   -0.4411   -1.4735 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3762   -0.9450    1.7197 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0097   -0.2429    1.8595 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7672   -1.9220    1.3525 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8721   -1.7978   -0.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4104   -0.1569   -0.3254 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5568   -0.4705   -1.8528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6727   -0.4879    1.2076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4330   -0.8666   -0.1845 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  7  1  0  0  0  0
  1 20  1  0  0  0  0
  2  6  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  3  9  1  0  0  0  0
  3 31  1  0  0  0  0
  3 32  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  6 16  1  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
  9 23  1  0  0  0  0
  9 24  1  0  0  0  0
 10 25  1  0  0  0  0
 10 26  1  0  0  0  0
 10 27  1  0  0  0  0
 11 28  1  0  0  0  0
 11 29  1  0  0  0  0
 11 30  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-11-02, 1768👍, 0💬