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(5E)-5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID AQ47eVfi3ZR
InChI InChI=1S/C18H16N4O5/c1-10-7-12(8-15-16(23)19-18(25)20(3)17(15)24)11(2)21(10)13-5-4-6-14(9-13)22(26)27/h4-9H,1-3H3,(H,19,23,25)/b15-8+
InChIKey SJYKAVWSVREAIA-OVCLIPMQSA-N
Mol Weight 368.35 g/mol
Molecular Formula C18H16N4O5
Exact Mass 368.11207 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7yqUfNZm3XB
Name (5E)-5-{[2,5-dimethyl-1-(3-nitrophenyl)-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/C18H16N4O5/c1-10-7-12(8-15-16(23)19-18(25)20(3)17(15)24)11(2)21(10)13-5-4-6-14(9-13)22(26)27/h4-9H,1-3H3,(H,19,23,25)/b15-8+
InChIKey SJYKAVWSVREAIA-OVCLIPMQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10096
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: 1001539; UBI_ID: UBI-010099
Synonyms 5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 315 °C