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(5E)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID BnfK78iCknC
InChI InChI=1S/C20H21N3O3/c1-11-6-7-16(8-12(11)2)23-13(3)9-15(14(23)4)10-17-18(24)21-20(26)22(5)19(17)25/h6-10H,1-5H3,(H,21,24,26)/b17-10+
InChIKey ZLWLGDPVSRFLKF-LICLKQGHSA-N
Mol Weight 351.41 g/mol
Molecular Formula C20H21N3O3
Exact Mass 351.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LwAUuZOhE6g
Name (5E)-5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-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/C20H21N3O3/c1-11-6-7-16(8-12(11)2)23-13(3)9-15(14(23)4)10-17-18(24)21-20(26)22(5)19(17)25/h6-10H,1-5H3,(H,21,24,26)/b17-10+
InChIKey ZLWLGDPVSRFLKF-LICLKQGHSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10091
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: 1001743; UBI_ID: UBI-010094
Synonyms 5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 315 °C