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(5E)-1-(4-methylphenyl)-5-{1-[(3-pyridinylmethyl)amino]propylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 4fREe7FDp1B
InChI InChI=1S/C20H20N4O3/c1-3-16(22-12-14-5-4-10-21-11-14)17-18(25)23-20(27)24(19(17)26)15-8-6-13(2)7-9-15/h4-11,22H,3,12H2,1-2H3,(H,23,25,27)/b17-16+
InChIKey NQOBZEIKVNHRHO-WUKNDPDISA-N
Mol Weight 364.41 g/mol
Molecular Formula C20H20N4O3
Exact Mass 364.153541 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7i5CU5atWDA
Name (5E)-1-(4-methylphenyl)-5-{1-[(3-pyridinylmethyl)amino]propylidene}-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/C20H20N4O3/c1-3-16(22-12-14-5-4-10-21-11-14)17-18(25)23-20(27)24(19(17)26)15-8-6-13(2)7-9-15/h4-11,22H,3,12H2,1-2H3,(H,23,25,27)/b17-16+
InChIKey NQOBZEIKVNHRHO-WUKNDPDISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26527
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: D63420; Labnumber: KKA-0212A-1283; SBI_ID: SBI-026531
Synonyms 1-(4-methylphenyl)-5-{1-[(3-pyridinylmethyl)amino]propylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C