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(5E)-5-[1-(hexylamino)propylidene]-1-(4-methylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID BNXzZY2uJtz
InChI InChI=1S/C20H27N3O3/c1-4-6-7-8-13-21-16(5-2)17-18(24)22-20(26)23(19(17)25)15-11-9-14(3)10-12-15/h9-12,21H,4-8,13H2,1-3H3,(H,22,24,26)/b17-16+
InChIKey QSRWTSFYUDJJQS-WUKNDPDISA-N
Mol Weight 357.45 g/mol
Molecular Formula C20H27N3O3
Exact Mass 357.205242 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3UjOQrPKj71
Name (5E)-5-[1-(hexylamino)propylidene]-1-(4-methylphenyl)-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/C20H27N3O3/c1-4-6-7-8-13-21-16(5-2)17-18(24)22-20(26)23(19(17)25)15-11-9-14(3)10-12-15/h9-12,21H,4-8,13H2,1-3H3,(H,22,24,26)/b17-16+
InChIKey QSRWTSFYUDJJQS-WUKNDPDISA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5101
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: E13305; Labnumber: KKA-0212A-1324; SBI_ID: SBI-005103
Synonyms 5-[1-(hexylamino)propylidene]-1-(4-methylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 306 °C