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(5E)-5-({1-[2-(2-chlorophenoxy)ethyl]-1H-pyrrol-2-yl}methylene)-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 3Q24RvcseYs
InChI InChI=1S/C22H18ClN3O5/c23-18-7-1-2-8-19(18)31-12-10-25-9-3-5-15(25)13-17-20(27)24-22(29)26(21(17)28)14-16-6-4-11-30-16/h1-9,11,13H,10,12,14H2,(H,24,27,29)/b17-13+
InChIKey HJQSWDZQPUOCLG-GHRIWEEISA-N
Mol Weight 439.86 g/mol
Molecular Formula C22H18ClN3O5
Exact Mass 439.093498 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BXX9KIytI5h
Name (5E)-5-({1-[2-(2-chlorophenoxy)ethyl]-1H-pyrrol-2-yl}methylene)-1-(2-furylmethyl)-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/C22H18ClN3O5/c23-18-7-1-2-8-19(18)31-12-10-25-9-3-5-15(25)13-17-20(27)24-22(29)26(21(17)28)14-16-6-4-11-30-16/h1-9,11,13H,10,12,14H2,(H,24,27,29)/b17-13+
InChIKey HJQSWDZQPUOCLG-GHRIWEEISA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19822
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: D14628; Labnumber: CEP2K-32155; SBI_ID: SBI-019826
Synonyms 5-({1-[2-(2-chlorophenoxy)ethyl]-1H-pyrrol-2-yl}methylene)-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C