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5-(4-fluorophenyl)-7-(1,1,2,2,2-pentafluoroethyl)-2-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}pyrazolo[1,5-a]pyrimidine
SpectraBase Compound ID KjhQ3lN4REF
InChI InChI=1S/C24H18F6N6O/c25-16-6-4-15(5-7-16)17-13-19(23(26,27)24(28,29)30)36-21(32-17)14-18(33-36)22(37)35-11-9-34(10-12-35)20-3-1-2-8-31-20/h1-8,13-14H,9-12H2
InChIKey VMMSMDBCWUDATJ-UHFFFAOYSA-N
Mol Weight 520.44 g/mol
Molecular Formula C24H18F6N6O
Exact Mass 520.144628 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G31W0FtE8h4
Name 5-(4-fluorophenyl)-7-(1,1,2,2,2-pentafluoroethyl)-2-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}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/C24H18F6N6O/c25-16-6-4-15(5-7-16)17-13-19(23(26,27)24(28,29)30)36-21(32-17)14-18(33-36)22(37)35-11-9-34(10-12-35)20-3-1-2-8-31-20/h1-8,13-14H,9-12H2
InChIKey VMMSMDBCWUDATJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1376
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/1176964; Labnumber: AC-NHALL/1295358; UZI_ID: UZI-001378
Temperature 313 °C