For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(5Z)-1-(2-fluorophenyl)-5-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

View entire compound with spectra: 1 NMR

(5Z)-1-(2-fluorophenyl)-5-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 1mXPBek73EF
InChI InChI=1S/C21H15FN4O3S/c1-12-14(20(29)26(24-12)13-7-3-2-4-8-13)11-15-18(27)23-21(30)25(19(15)28)17-10-6-5-9-16(17)22/h2-11,29H,1H3,(H,23,27,30)/b15-11-
InChIKey LSPPPWWJTROANW-PTNGSMBKSA-N
Mol Weight 422.43 g/mol
Molecular Formula C21H15FN4O3S
Exact Mass 422.08489 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2pYg4yF0pUQ
Name (5Z)-1-(2-fluorophenyl)-5-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C21H15FN4O3S/c1-12-14(20(29)26(24-12)13-7-3-2-4-8-13)11-15-18(27)23-21(30)25(19(15)28)17-10-6-5-9-16(17)22/h2-11,29H,1H3,(H,23,27,30)/b15-11-
InChIKey LSPPPWWJTROANW-PTNGSMBKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22794
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: D35822; Labnumber: SPDEM4-14950; SBI_ID: SBI-022798
Synonyms 1-(2-fluorophenyl)-5-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 308 °C