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2,4,6(1H,3H,5H)-pyrimidinetrione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[(5-methyl-3-isoxazolyl)amino]methylene]-, (5Z)-
SpectraBase Compound ID EOAgrMZuj2J
InChI InChI=1S/C19H20N4O6/c1-11-8-16(22-29-11)20-10-13-17(24)21-19(26)23(18(13)25)7-6-12-4-5-14(27-2)15(9-12)28-3/h4-5,8-10H,6-7H2,1-3H3,(H,20,22)(H,21,24,26)/b13-10-
InChIKey LQCCKWPEAVNLTK-RAXLEYEMSA-N
Mol Weight 400.39 g/mol
Molecular Formula C19H20N4O6
Exact Mass 400.138284 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KjvkAg05MGT
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[(5-methyl-3-isoxazolyl)amino]methylene]-, (5Z)-
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/C19H20N4O6/c1-11-8-16(22-29-11)20-10-13-17(24)21-19(26)23(18(13)25)7-6-12-4-5-14(27-2)15(9-12)28-3/h4-5,8-10H,6-7H2,1-3H3,(H,20,22)(H,21,24,26)/b13-10-
InChIKey LQCCKWPEAVNLTK-RAXLEYEMSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_198
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: F03249; Labnumber: KV-05-054-0591