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pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 5-phenyl-7-(trifluoromethyl)-, butyl ester
SpectraBase Compound ID JwNCIPJGA3a
InChI InChI=1S/C18H16F3N3O2/c1-2-3-9-26-17(25)14-11-16-22-13(12-7-5-4-6-8-12)10-15(18(19,20)21)24(16)23-14/h4-8,10-11H,2-3,9H2,1H3
InChIKey NKCVLVBDNVHSQM-UHFFFAOYSA-N
Mol Weight 363.34 g/mol
Molecular Formula C18H16F3N3O2
Exact Mass 363.119461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E0XaOidSrZF
Name pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 5-phenyl-7-(trifluoromethyl)-, butyl ester
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/C18H16F3N3O2/c1-2-3-9-26-17(25)14-11-16-22-13(12-7-5-4-6-8-12)10-15(18(19,20)21)24(16)23-14/h4-8,10-11H,2-3,9H2,1H3
InChIKey NKCVLVBDNVHSQM-UHFFFAOYSA-N
NMR Offset 15.8701
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_3793
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: ZI/5129018; Labnumber: ID_0000123; IOH_ID: IOH-010796
Temperature 313 °C