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(5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-methoxybenzyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID COAmWxWjkxL
InChI InChI=1S/C26H25N3O4/c1-16-5-9-21(10-6-16)29-17(2)13-20(18(29)3)14-23-24(30)27-26(32)28(25(23)31)15-19-7-11-22(33-4)12-8-19/h5-14H,15H2,1-4H3,(H,27,30,32)/b23-14-
InChIKey HFIQDXJJSSSJSU-UCQKPKSFSA-N
Mol Weight 443.5 g/mol
Molecular Formula C26H25N3O4
Exact Mass 443.184506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2guteehaoPo
Name (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-methoxybenzyl)-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/C26H25N3O4/c1-16-5-9-21(10-6-16)29-17(2)13-20(18(29)3)14-23-24(30)27-26(32)28(25(23)31)15-19-7-11-22(33-4)12-8-19/h5-14H,15H2,1-4H3,(H,27,30,32)/b23-14-
InChIKey HFIQDXJJSSSJSU-UCQKPKSFSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13918
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: D91064; Labnumber: KKA-0212B-0313; SBI_ID: SBI-013921
Synonyms 5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-1-(4-methoxybenzyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C