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benzoic acid, 4-[6-(2,5-dimethoxyphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-
SpectraBase Compound ID 6nVsHJUqt9T
InChI InChI=1S/C23H18F3N3O4/c1-12-20-17(23(24,25)26)11-18(16-10-15(32-2)8-9-19(16)33-3)27-21(20)29(28-12)14-6-4-13(5-7-14)22(30)31/h4-11H,1-3H3,(H,30,31)
InChIKey GBLHJTUXWUZMGW-UHFFFAOYSA-N
Mol Weight 457.41 g/mol
Molecular Formula C23H18F3N3O4
Exact Mass 457.124941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L04wqUNHfvL
Name benzoic acid, 4-[6-(2,5-dimethoxyphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]-
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/C23H18F3N3O4/c1-12-20-17(23(24,25)26)11-18(16-10-15(32-2)8-9-19(16)33-3)27-21(20)29(28-12)14-6-4-13(5-7-14)22(30)31/h4-11H,1-3H3,(H,30,31)
InChIKey GBLHJTUXWUZMGW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23219
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: 2277493; UZI_ID: UZI-023227
Temperature 308 °C