For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-pyrazolo[3,4-b]pyridine, 4-(difluoromethyl)-1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-3-methyl-6-(5-methyl-2-thienyl)-
SpectraBase Compound ID D4oPliHAaTu
InChI InChI=1S/C25H18F5N5OS/c1-12-4-9-19(37-12)18-10-16(22(26)27)21-13(2)34-35(23(21)31-18)24-32-17(11-20(33-24)25(28,29)30)14-5-7-15(36-3)8-6-14/h4-11,22H,1-3H3
InChIKey QGWBANGURZLDLC-UHFFFAOYSA-N
Mol Weight 531.51 g/mol
Molecular Formula C25H18F5N5OS
Exact Mass 531.115222 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6b7Gi7Ku95j
Name 1H-pyrazolo[3,4-b]pyridine, 4-(difluoromethyl)-1-[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-3-methyl-6-(5-methyl-2-thienyl)-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H18F5N5OS/c1-12-4-9-19(37-12)18-10-16(22(26)27)21-13(2)34-35(23(21)31-18)24-32-17(11-20(33-24)25(28,29)30)14-5-7-15(36-3)8-6-14/h4-11,22H,1-3H3
InChIKey QGWBANGURZLDLC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_22550
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 2222407; UZI_ID: UZI-022558
Temperature 308 °C