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

*Links on SpectraBase are not permalinks.
(5E)-1-(1,3-benzodioxol-5-yl)-5-{[5-(3-chlorophenyl)-2-furyl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID K0AkX9xCvzH
InChI InChI=1S/C22H13ClN2O6/c23-13-3-1-2-12(8-13)17-7-5-15(31-17)10-16-20(26)24-22(28)25(21(16)27)14-4-6-18-19(9-14)30-11-29-18/h1-10H,11H2,(H,24,26,28)/b16-10+
InChIKey CXSFAYVKKJMVRS-MHWRWJLKSA-N
Mol Weight 436.81 g/mol
Molecular Formula C22H13ClN2O6
Exact Mass 436.046214 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 IthU8xjFl7y
Name (5E)-1-(1,3-benzodioxol-5-yl)-5-{[5-(3-chlorophenyl)-2-furyl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H13ClN2O6/c23-13-3-1-2-12(8-13)17-7-5-15(31-17)10-16-20(26)24-22(28)25(21(16)27)14-4-6-18-19(9-14)30-11-29-18/h1-10H,11H2,(H,24,26,28)/b16-10+
InChIKey CXSFAYVKKJMVRS-MHWRWJLKSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10061
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: 1001105; UBI_ID: UBI-010064
Synonyms 1-(1,3-benzodioxol-5-yl)-5-{[5-(3-chlorophenyl)-2-furyl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 315 °C