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(5E)-5-{[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 7fuu1bfcMe1
InChI InChI=1S/C19H17N3O5/c1-10-6-12(7-14-17(23)20-19(25)21(3)18(14)24)11(2)22(10)13-4-5-15-16(8-13)27-9-26-15/h4-8H,9H2,1-3H3,(H,20,23,25)/b14-7+
InChIKey KTKAJJLUVLAJLW-VGOFMYFVSA-N
Mol Weight 367.36 g/mol
Molecular Formula C19H17N3O5
Exact Mass 367.116821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AJ9q4nJTRsN
Name (5E)-5-{[1-(1,3-benzodioxol-5-yl)-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/C19H17N3O5/c1-10-6-12(7-14-17(23)20-19(25)21(3)18(14)24)11(2)22(10)13-4-5-15-16(8-13)27-9-26-15/h4-8H,9H2,1-3H3,(H,20,23,25)/b14-7+
InChIKey KTKAJJLUVLAJLW-VGOFMYFVSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3211
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: 113126; Labnumber: PAVL-07197; VK_ID: VK-003212
Synonyms 5-{[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-methyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C