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N-(2-adamantyl)-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID GTWcxgsYi7q
InChI InChI=1S/C22H21F3N4OS/c23-22(24,25)18-9-16(17-2-1-3-31-17)27-20-15(10-26-29(18)20)21(30)28-19-13-5-11-4-12(7-13)8-14(19)6-11/h1-3,9-14,19H,4-8H2,(H,28,30)/t11-,12+,13-,14+,19?
InChIKey WCYXHWJXBXHPIQ-SUKVGQHKSA-N
Mol Weight 446.49 g/mol
Molecular Formula C22H21F3N4OS
Exact Mass 446.138817 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LiXWoY5gcYG
Name N-(2-adamantyl)-5-(2-thienyl)-7-(trifluoromethyl)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/C22H21F3N4OS/c23-22(24,25)18-9-16(17-2-1-3-31-17)27-20-15(10-26-29(18)20)21(30)28-19-13-5-11-4-12(7-13)8-14(19)6-11/h1-3,9-14,19H,4-8H2,(H,28,30)/t11-,12+,13-,14+,19?
InChIKey WCYXHWJXBXHPIQ-SUKVGQHKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_687
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/1187768; Labnumber: AC-NHALL/0208240; UZI_ID: UZI-000689
Temperature 313 °C