SpectraBase Spectrum ID |
DXEoG2yexE5 |
Name |
6-(4-Bromophenyl)-4-(perfluoroethyl)-2-phenyl-1H-pyrazolo[3,4-b]pyridin-3(2H)-one |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
483.000565800 u |
Formula |
C20H11BrF5N3O |
InChI |
InChI=1S/C20H11BrF5N3O/c21-12-8-6-11(7-9-12)15-10-14(19(22,23)20(24,25)26)16-17(27-15)28-29(18(16)30)13-4-2-1-3-5-13/h1-10H,(H,27,28) |
InChIKey |
FVOQQKOPIAUXBA-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.201800163 |
Molecular Weight |
484.224 g/mol |
Quality |
261 |
Reported Formula |
C20H11BrF5N3O |
SMILES |
N1C2=NC(=CC(=C2C(N1C1=CC=CC=C1)=O)C(F)(F)C(F)(F)F)C1=CC=C(C=C1)Br |
SPLASH |
splash10-0040-3000900000-91011e2a10c5d54273e9 |
Source of Spectrum |
K1-2018-2641-2y (DOI: 10.1002/ejoc.201800163) |
Wiley ID |
1891672 |