SpectraBase Spectrum ID |
E8BGbm00fkY |
Name |
4-(Perfluoroethyl)-2,6-diphenyl-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 |
405.090052832 u |
Formula |
C20H12F5N3O |
InChI |
InChI=1S/C20H12F5N3O/c21-19(22,20(23,24)25)14-11-15(12-7-3-1-4-8-12)26-17-16(14)18(29)28(27-17)13-9-5-2-6-10-13/h1-11H,(H,26,27) |
InChIKey |
MZDYONUILPAQRL-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.201800163 |
Molecular Weight |
405.328 g/mol |
Quality |
130 |
Reported Formula |
C20H12F5N3O |
SMILES |
N1N(C(C=2C1=NC(=CC2C(C(F)(F)F)(F)F)C1=CC=CC=C1)=O)C1=CC=CC=C1 |
SPLASH |
splash10-0a4i-1002900000-655a9b6e8dc891bb4ab9 |
Source of Spectrum |
K1-2018-2639-2m (DOI: 10.1002/ejoc.201800163) |
Wiley ID |
1891662 |