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N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

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N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID FEIC3YtDPEw
InChI InChI=1S/C25H18ClF3N6O/c1-14-5-7-15(8-6-14)20-11-21(23(28)29)35-24(31-20)16(12-30-35)25(36)32-22-9-10-34(33-22)13-17-18(26)3-2-4-19(17)27/h2-12,23H,13H2,1H3,(H,32,33,36)
InChIKey CCMQRYLKPOBSQN-UHFFFAOYSA-N
Mol Weight 510.91 g/mol
Molecular Formula C25H18ClF3N6O
Exact Mass 510.118271 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L3EzGOqKfm4
Name N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-7-(difluoromethyl)-5-(4-methylphenyl)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/C25H18ClF3N6O/c1-14-5-7-15(8-6-14)20-11-21(23(28)29)35-24(31-20)16(12-30-35)25(36)32-22-9-10-34(33-22)13-17-18(26)3-2-4-19(17)27/h2-12,23H,13H2,1H3,(H,32,33,36)
InChIKey CCMQRYLKPOBSQN-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3849
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: 9318599; UBI_ID: UBI-003850
Temperature 308 °C