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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(4-hydroxy-2-methylphenyl)amino]methylene]-
SpectraBase Compound ID JKygGPET1uJ
InChI InChI=1S/C12H11N3O4/c1-6-4-7(16)2-3-9(6)13-5-8-10(17)14-12(19)15-11(8)18/h2-5,13,16H,1H3,(H2,14,15,17,18,19)
InChIKey KZYQDSDHKFUJDK-UHFFFAOYSA-N
Mol Weight 261.24 g/mol
Molecular Formula C12H11N3O4
Exact Mass 261.074956 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 30niJjPAqeK
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(4-hydroxy-2-methylphenyl)amino]methylene]-
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/C12H11N3O4/c1-6-4-7(16)2-3-9(6)13-5-8-10(17)14-12(19)15-11(8)18/h2-5,13,16H,1H3,(H2,14,15,17,18,19)
InChIKey KZYQDSDHKFUJDK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1585
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: AG-205/5057839; Labnumber: MAR-990; IOH_ID: IOH-008588