SpectraBase Spectrum ID |
5w0vpZebZOq |
Name |
2-(3-Methyl-5-nitro-1-phenyl-4-trifluoromethyl-1H-pyrazolo[3,4-b]pyridin-6-yl)phenol |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H13F3N4O3 |
InChI |
InChI=1S/C20H13F3N4O3/c1-11-15-16(20(21,22)23)18(27(29)30)17(13-9-5-6-10-14(13)28)24-19(15)26(25-11)12-7-3-2-4-8-12/h2-10,28H,1H3 |
InChIKey |
VYDVGLYRQBEKRL-UHFFFAOYSA-N |
Molecular Weight |
414.344 g/mol |
SMILES |
Oc1c(-c2nc3c(c(c2N(=O)=O)C(F)(F)F)c(n[n]3-c2ccccc2)C)cccc1 |
SPLASH |
splash10-00di-0009000000-4e0c4a55ed5373349548 |
Source of Spectrum |
F-68-2540-3t |
Wiley ID |
1708747 |