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N-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

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N-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID 46A0B9qgyMK
InChI InChI=1S/C27H23BrF2N6O/c1-15-4-8-19(9-5-15)22-12-23(25(29)30)36-26(32-22)21(13-31-36)27(37)33-24-16(2)34-35(17(24)3)14-18-6-10-20(28)11-7-18/h4-13,25H,14H2,1-3H3,(H,33,37)
InChIKey ZBNJODYZEZIQLQ-UHFFFAOYSA-N
Mol Weight 565.42 g/mol
Molecular Formula C27H23BrF2N6O
Exact Mass 564.108479 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FINBYLPVmEY
Name N-[1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-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/C27H23BrF2N6O/c1-15-4-8-19(9-5-15)22-12-23(25(29)30)36-26(32-22)21(13-31-36)27(37)33-24-16(2)34-35(17(24)3)14-18-6-10-20(28)11-7-18/h4-13,25H,14H2,1-3H3,(H,33,37)
InChIKey ZBNJODYZEZIQLQ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3835
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: 9317339; UBI_ID: UBI-003836
Temperature 308 °C