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(5E)-5-{[1-(4-isopropylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID l205fvtF7v
InChI InChI=1S/C21H23N3O3/c1-12(2)15-6-8-17(9-7-15)24-13(3)10-16(14(24)4)11-18-19(25)22-21(27)23(5)20(18)26/h6-12H,1-5H3,(H,22,25,27)/b18-11+
InChIKey WURBBPCVWCWEIH-WOJGMQOQSA-N
Mol Weight 365.43 g/mol
Molecular Formula C21H23N3O3
Exact Mass 365.173942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BVFQX2X1Yn9
Name (5E)-5-{[1-(4-isopropylphenyl)-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/C21H23N3O3/c1-12(2)15-6-8-17(9-7-15)24-13(3)10-16(14(24)4)11-18-19(25)22-21(27)23(5)20(18)26/h6-12H,1-5H3,(H,22,25,27)/b18-11+
InChIKey WURBBPCVWCWEIH-WOJGMQOQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10076
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: 1001725; UBI_ID: UBI-010079
Synonyms 5-{[1-(4-isopropylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 315 °C