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(5E)-1-benzyl-5-{1-[(3-pyridinylmethyl)amino]propylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID IxtogIOs9SX
InChI InChI=1S/C20H20N4O3/c1-2-16(22-12-15-9-6-10-21-11-15)17-18(25)23-20(27)24(19(17)26)13-14-7-4-3-5-8-14/h3-11,22H,2,12-13H2,1H3,(H,23,25,27)/b17-16+
InChIKey ZZTGNNZVIKVYFP-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 EeV8SAx0xc
Name (5E)-1-benzyl-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/c1-2-16(22-12-15-9-6-10-21-11-15)17-18(25)23-20(27)24(19(17)26)13-14-7-4-3-5-8-14/h3-11,22H,2,12-13H2,1H3,(H,23,25,27)/b17-16+
InChIKey ZZTGNNZVIKVYFP-WUKNDPDISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13554
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: D86199; Labnumber: KKA-0212A-1061; SBI_ID: SBI-013557
Synonyms 1-benzyl-5-{1-[(3-pyridinylmethyl)amino]propylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C