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N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-7-(difluoromethyl)-5-(4-methoxyphenyl)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-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID IsWMrnUVJhy
InChI InChI=1S/C25H18ClF3N6O2/c1-37-15-7-5-14(6-8-15)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 HXCSZMRRKKQPNM-UHFFFAOYSA-N
Mol Weight 526.91 g/mol
Molecular Formula C25H18ClF3N6O2
Exact Mass 526.113186 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2w5ga0TUMMn
Name N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-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/C25H18ClF3N6O2/c1-37-15-7-5-14(6-8-15)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 HXCSZMRRKKQPNM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9899
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/9319506; Labnumber: IRA1285; UZI_ID: UZI-009901
Temperature 308 °C