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N-(1-adamantyl)-3-bromo-5-(2-thienyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID AZDhtQGrUoZ
InChI InChI=1S/C22H24BrF3N4OS/c23-17-18(20(31)28-21-8-11-4-12(9-21)6-13(5-11)10-21)29-30-16(22(24,25)26)7-14(27-19(17)30)15-2-1-3-32-15/h1-3,11-14,16,27H,4-10H2,(H,28,31)/t11-,12+,13-,14?,16?,21-
InChIKey ZPJPDWYWVWFZTD-DIWPEXAPSA-N
Mol Weight 529.42 g/mol
Molecular Formula C22H24BrF3N4OS
Exact Mass 528.08063 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jr1WlL4EVnZ
Name N-(1-adamantyl)-3-bromo-5-(2-thienyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[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/C22H24BrF3N4OS/c23-17-18(20(31)28-21-8-11-4-12(9-21)6-13(5-11)10-21)29-30-16(22(24,25)26)7-14(27-19(17)30)15-2-1-3-32-15/h1-3,11-14,16,27H,4-10H2,(H,28,31)/t11-,12+,13-,14?,16?,21-
InChIKey ZPJPDWYWVWFZTD-DIWPEXAPSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12082
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/9100030; UBI_ID: UBI-012085
Temperature 313 °C