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N-(3-chloro-4-fluorophenyl)-7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID KiyWq8kI1YA
InChI InChI=1S/C21H14ClF3N4O2/c1-31-13-5-2-11(3-6-13)17-9-18(19(24)25)29-20(28-17)14(10-26-29)21(30)27-12-4-7-16(23)15(22)8-12/h2-10,19H,1H3,(H,27,30)
InChIKey XJSMJDHFUJWYSJ-UHFFFAOYSA-N
Mol Weight 446.82 g/mol
Molecular Formula C21H14ClF3N4O2
Exact Mass 446.075738 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 92QgVGeruZv
Name N-(3-chloro-4-fluorophenyl)-7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
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/C21H14ClF3N4O2/c1-31-13-5-2-11(3-6-13)17-9-18(19(24)25)29-20(28-17)14(10-26-29)21(30)27-12-4-7-16(23)15(22)8-12/h2-10,19H,1H3,(H,27,30)
InChIKey XJSMJDHFUJWYSJ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13896
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: UZI/9318303; UBI_ID: UBI-013899
Temperature 308 °C