Molecule FYI-1016176

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Molecule Summary:

ID: FYI-1016176
Names:
InChIKey: BLHVJAAEHMLMOI-UHFFFAOYSA-N
SMILES: CN(C)CCOP(=O)(O)O

Received at FYIcenter.com on: 2025-11-29

Molecule ID: FYI-1016176 Edit

Molecule Structure InChIKey: BLHVJAAEHMLMOI-UHFFFAOYSA-N

Molecule Structure SMILES String: CN(C)CCOP(=O)(O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016176
FYIcenter.com

 10  9  0  0  0  0  0  0  0  0999 V2000
    6.0621    1.2124    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    6.7621    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.5124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.5124    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
    1.2124    2.6124    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
    7.2747    1.9124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3621    2.4248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  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  6  1  0  0  0  0
  9  1  1  0  0  0  0
 10  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016176-3D
FYIcenter.com

 22 21  0     0  0  0  0  0  0999 V2000
    2.3316   -0.0605   -0.0449 P   0  0  0  0  0  0  0  0  0  0  0  0
    0.8542   -0.6504   -0.3345 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3649    0.1232    1.5614 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2234    1.4578   -0.5908 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4608   -0.8627   -0.6225 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7168   -0.0027    0.3088 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5345   -0.6848   -0.2163 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2672    0.0550    0.1811 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9300   -0.7409   -0.0404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7864    1.3659   -0.2018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5749   -0.7894   -1.3091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4788   -1.7057    0.1836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1856    0.1195    1.2712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2331    1.0626   -0.2395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8126   -0.2634    0.3998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8919   -1.7584    0.3645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0773   -0.8061   -1.1246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7480    1.8227    0.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6877    1.4133   -1.2926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0339    2.0130    0.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1984    0.4150    1.9885 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0317    2.0130   -0.6126 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  8  1  0  0  0  0
  3 21  1  0  0  0  0
  4 22  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
M  END
$$$$

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