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N-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-(4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID EDuFP488CDM
InChI InChI=1S/C27H26ClF3N6O/c1-14-7-9-17(10-8-14)22-11-23(25(30)31)37-26(33-22)18(12-32-37)27(38)34-24-15(2)35-36(16(24)3)13-19-20(28)5-4-6-21(19)29/h4-10,12,22-23,25,33H,11,13H2,1-3H3,(H,34,38)
InChIKey SJDVRRFLHZFBJY-UHFFFAOYSA-N
Mol Weight 542.99 g/mol
Molecular Formula C27H26ClF3N6O
Exact Mass 542.180872 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EQMDsywCFLd
Name N-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-7-(difluoromethyl)-5-(4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[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/C27H26ClF3N6O/c1-14-7-9-17(10-8-14)22-11-23(25(30)31)37-26(33-22)18(12-32-37)27(38)34-24-15(2)35-36(16(24)3)13-19-20(28)5-4-6-21(19)29/h4-10,12,22-23,25,33H,11,13H2,1-3H3,(H,34,38)
InChIKey SJDVRRFLHZFBJY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8664
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/1009890; Labnumber: E1626; UZI_ID: UZI-008666
Temperature 308 °C