Molecule FYI-1006466

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A

Molecule Summary:

ID: FYI-1006466
Names:
InChIKey: OKVSEMVTWRBCDC-UHFFFAOYSA-N
SMILES: C=N(C)(C)CCCCCCCCCCCCCCCC

Received at FYIcenter.com on: 2023-12-22

Molecule ID: FYI-1006466 Edit

Molecule Structure InChIKey: OKVSEMVTWRBCDC-UHFFFAOYSA-N

Molecule Structure SMILES String: C=N(C)(C)CCCCCCCCCCCCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1006466
FYIcenter.com

 20 19  0  0  0  0  0  0  0  0999 V2000
   20.6114    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3369    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.2124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.5124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    2.4248    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 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 17  1  0  0  0  0
 20 17  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006466-3D
FYIcenter.com

 61 60  0  0  0  0  0  0  0  0999 V2000
    2.5602   -0.3614   -1.4655 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2544   -0.2486   -0.2442 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7203   -0.0060   -0.2147 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4647   -1.5832    0.4904 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0048    0.9569    0.4057 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5350    0.8145    0.3384 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2631    2.0108    0.9692 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7786    1.8114    0.8753 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5558    2.9753    1.4847 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0603    2.7364    1.3671 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8455    3.8927    1.9759 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3463    3.6533    1.8559 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1234    4.8139    2.4666 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6235    4.5777    2.3484 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4006    5.7372    2.9602 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9003    5.4993    2.8394 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6830    6.6567    3.4496 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1840    6.4170    3.3296 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9711    7.5732    3.9386 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4662    7.3372    3.8185 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3872   -1.3034   -2.0365 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9847    0.4826   -2.0447 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2254   -0.8580   -0.7031 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4970    0.9173   -0.7587 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3931    0.0633    0.8277 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9103   -2.3732   -0.0338 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0811   -1.4878    1.5117 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5308   -1.8197    0.4921 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6556    1.0494    1.4407 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7076    1.8571   -0.1503 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8646    0.7552   -0.7063 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8560   -0.1071    0.8363 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9636    2.1293    2.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9849    2.9333    0.4446 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0683    1.6964   -0.1772 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0559    0.8824    1.3872 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2836    3.0902    2.5406 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2899    3.9100    0.9756 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3372    2.6175    0.3123 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3274    1.8025    1.8774 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5750    4.0076    3.0323 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5798    4.8281    1.4691 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6219    3.5378    0.8005 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6161    2.7202    2.3654 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8487    4.9296    3.5223 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8551    5.7479    1.9579 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8973    4.4641    1.2925 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8929    3.6431    2.8556 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1256    5.8511    4.0162 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1305    6.6718    2.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1711    5.3857    1.7821 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1695    4.5630    3.3439 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4095    6.7716    4.5054 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4153    7.5913    2.9414 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.4550    6.3000    2.2728 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.4490    5.4808    3.8362 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.7053    7.6896    4.9960 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.7089    8.5097    3.4327 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.7594    6.4194    4.3379 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.0198    8.1712    4.2589 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.7622    7.2467    2.7682 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3 23  1  0  0  0  0
  3 24  1  0  0  0  0
  3 25  1  0  0  0  0
  4 26  1  0  0  0  0
  4 27  1  0  0  0  0
  4 28  1  0  0  0  0
  5  6  1  0  0  0  0
  5 29  1  0  0  0  0
  5 30  1  0  0  0  0
  6  7  1  0  0  0  0
  6 31  1  0  0  0  0
  6 32  1  0  0  0  0
  7  8  1  0  0  0  0
  7 33  1  0  0  0  0
  7 34  1  0  0  0  0
  8  9  1  0  0  0  0
  8 35  1  0  0  0  0
  8 36  1  0  0  0  0
  9 10  1  0  0  0  0
  9 37  1  0  0  0  0
  9 38  1  0  0  0  0
 10 11  1  0  0  0  0
 10 39  1  0  0  0  0
 10 40  1  0  0  0  0
 11 12  1  0  0  0  0
 11 41  1  0  0  0  0
 11 42  1  0  0  0  0
 12 13  1  0  0  0  0
 12 43  1  0  0  0  0
 12 44  1  0  0  0  0
 13 14  1  0  0  0  0
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 13 46  1  0  0  0  0
 14 15  1  0  0  0  0
 14 47  1  0  0  0  0
 14 48  1  0  0  0  0
 15 16  1  0  0  0  0
 15 49  1  0  0  0  0
 15 50  1  0  0  0  0
 16 17  1  0  0  0  0
 16 51  1  0  0  0  0
 16 52  1  0  0  0  0
 17 18  1  0  0  0  0
 17 53  1  0  0  0  0
 17 54  1  0  0  0  0
 18 19  1  0  0  0  0
 18 55  1  0  0  0  0
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 19 20  1  0  0  0  0
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 19 58  1  0  0  0  0
 20 59  1  0  0  0  0
 20 60  1  0  0  0  0
 20 61  1  0  0  0  0
M  END
$$$$

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2023-12-31, 2604👍, 0💬