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3-chloro-2-[(2-ethyl-1-piperidinyl)carbonyl]-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SpectraBase Compound ID 4oenS4Zu662
InChI InChI=1S/C21H19ClF4N4O/c1-2-14-5-3-4-10-29(14)20(31)18-17(22)19-27-15(12-6-8-13(23)9-7-12)11-16(21(24,25)26)30(19)28-18/h6-9,11,14H,2-5,10H2,1H3
InChIKey LDNMQNUDRDYUAG-UHFFFAOYSA-N
Mol Weight 454.86 g/mol
Molecular Formula C21H19ClF4N4O
Exact Mass 454.118352 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CH0a8pNvV9n
Name 3-chloro-2-[(2-ethyl-1-piperidinyl)carbonyl]-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
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/C21H19ClF4N4O/c1-2-14-5-3-4-10-29(14)20(31)18-17(22)19-27-15(12-6-8-13(23)9-7-12)11-16(21(24,25)26)30(19)28-18/h6-9,11,14H,2-5,10H2,1H3
InChIKey LDNMQNUDRDYUAG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18066
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/9099851; UBI_ID: UBI-018069
Temperature 308 °C