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(5E)-1-benzyl-5-(1-{[3-(1H-imidazol-1-yl)propyl]amino}propylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID IKykprbMODs
InChI InChI=1S/C20H23N5O3/c1-2-16(22-9-6-11-24-12-10-21-14-24)17-18(26)23-20(28)25(19(17)27)13-15-7-4-3-5-8-15/h3-5,7-8,10,12,14,22H,2,6,9,11,13H2,1H3,(H,23,26,28)/b17-16+
InChIKey YOWAXGSERDROQA-WUKNDPDISA-N
Mol Weight 381.44 g/mol
Molecular Formula C20H23N5O3
Exact Mass 381.18009 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6NPFxlYpDyy
Name (5E)-1-benzyl-5-(1-{[3-(1H-imidazol-1-yl)propyl]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/C20H23N5O3/c1-2-16(22-9-6-11-24-12-10-21-14-24)17-18(26)23-20(28)25(19(17)27)13-15-7-4-3-5-8-15/h3-5,7-8,10,12,14,22H,2,6,9,11,13H2,1H3,(H,23,26,28)/b17-16+
InChIKey YOWAXGSERDROQA-WUKNDPDISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13909
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: D91032; Labnumber: KKA-0212A-1066; SBI_ID: SBI-013912
Synonyms 1-benzyl-5-(1-{[3-(1H-imidazol-1-yl)propyl]amino}propylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C