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3-bromo-N-[3-(1H-imidazol-1-yl)propyl]-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID 4lqtn10cxuD
InChI InChI=1S/C20H16BrF3N6O/c21-16-17(19(31)26-7-4-9-29-10-8-25-12-29)28-30-15(20(22,23)24)11-14(27-18(16)30)13-5-2-1-3-6-13/h1-3,5-6,8,10-12H,4,7,9H2,(H,26,31)
InChIKey AJFYLPHGLIBJBI-UHFFFAOYSA-N
Mol Weight 493.29 g/mol
Molecular Formula C20H16BrF3N6O
Exact Mass 492.052107 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7wK5ndbnLbC
Name 3-bromo-N-[3-(1H-imidazol-1-yl)propyl]-5-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/C20H16BrF3N6O/c21-16-17(19(31)26-7-4-9-29-10-8-25-12-29)28-30-15(20(22,23)24)11-14(27-18(16)30)13-5-2-1-3-6-13/h1-3,5-6,8,10-12H,4,7,9H2,(H,26,31)
InChIKey AJFYLPHGLIBJBI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9477
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/8011248; Labnumber: IDV-0001621; UZI_ID: UZI-009479
Temperature 318 °C