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5-(4-chlorophenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID 16rsyszMs6R
InChI InChI=1S/C21H14ClF3N4OS/c1-31-17-5-3-2-4-14(17)27-20(30)16-11-19-26-15(12-6-8-13(22)9-7-12)10-18(21(23,24)25)29(19)28-16/h2-11H,1H3,(H,27,30)
InChIKey VOWQRPOPROPIRN-UHFFFAOYSA-N
Mol Weight 462.88 g/mol
Molecular Formula C21H14ClF3N4OS
Exact Mass 462.052894 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3jFXQT8mnT5
Name 5-(4-chlorophenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-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/C21H14ClF3N4OS/c1-31-17-5-3-2-4-14(17)27-20(30)16-11-19-26-15(12-6-8-13(22)9-7-12)10-18(21(23,24)25)29(19)28-16/h2-11H,1H3,(H,27,30)
InChIKey VOWQRPOPROPIRN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1526
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: NMR/9278688; Labnumber: BAS1059294
Temperature 297 °C