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pyrazolo[1,5-a]pyrimidin-7(4H)-one, 5-[[(4-chlorophenyl)thio]methyl]-2-ethyl-3-(4-fluorophenyl)-
SpectraBase Compound ID 8WhN6sc4WRz
InChI InChI=1S/C21H17ClFN3OS/c1-2-18-20(13-3-7-15(23)8-4-13)21-24-16(11-19(27)26(21)25-18)12-28-17-9-5-14(22)6-10-17/h3-11,24H,2,12H2,1H3
InChIKey TXCYCYYOSQRFLH-UHFFFAOYSA-N
Mol Weight 413.9 g/mol
Molecular Formula C21H17ClFN3OS
Exact Mass 413.076489 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2hV6FJFqtdb
Name pyrazolo[1,5-a]pyrimidin-7(4H)-one, 5-[[(4-chlorophenyl)thio]methyl]-2-ethyl-3-(4-fluorophenyl)-
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/C21H17ClFN3OS/c1-2-18-20(13-3-7-15(23)8-4-13)21-24-16(11-19(27)26(21)25-18)12-28-17-9-5-14(22)6-10-17/h3-11,24H,2,12H2,1H3
InChIKey TXCYCYYOSQRFLH-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2531
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: F15129; Labnumber: VGU-S1059-0869