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(5Z)-1-(4-chlorophenyl)-5-({5-[(4-methylphenyl)sulfanyl]-2-furyl}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID HNqOdgt44o6
InChI InChI=1S/C22H15ClN2O4S/c1-13-2-9-17(10-3-13)30-19-11-8-16(29-19)12-18-20(26)24-22(28)25(21(18)27)15-6-4-14(23)5-7-15/h2-12H,1H3,(H,24,26,28)/b18-12-
InChIKey ZMNVFZSDSAWDOO-PDGQHHTCSA-N
Mol Weight 438.89 g/mol
Molecular Formula C22H15ClN2O4S
Exact Mass 438.044106 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 25AFHICh53X
Name (5Z)-1-(4-chlorophenyl)-5-({5-[(4-methylphenyl)sulfanyl]-2-furyl}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C22H15ClN2O4S/c1-13-2-9-17(10-3-13)30-19-11-8-16(29-19)12-18-20(26)24-22(28)25(21(18)27)15-6-4-14(23)5-7-15/h2-12H,1H3,(H,24,26,28)/b18-12-
InChIKey ZMNVFZSDSAWDOO-PDGQHHTCSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25617
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: C69433; Labnumber: CEP2K-10511; SBI_ID: SBI-025621
Synonyms 1-(4-chlorophenyl)-5-({5-[(4-methylphenyl)sulfanyl]-2-furyl}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 306 °C