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(5Z)-1-(3,4-dimethylphenyl)-5-{[(1-phenylethyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID BsCfPsm1D1d
InChI InChI=1S/C21H21N3O3/c1-13-9-10-17(11-14(13)2)24-20(26)18(19(25)23-21(24)27)12-22-15(3)16-7-5-4-6-8-16/h4-12,15,22H,1-3H3,(H,23,25,27)/b18-12-
InChIKey KVTDSPBIYMMROZ-PDGQHHTCSA-N
Mol Weight 363.42 g/mol
Molecular Formula C21H21N3O3
Exact Mass 363.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5BXS0wLr1Py
Name (5Z)-1-(3,4-dimethylphenyl)-5-{[(1-phenylethyl)amino]methylene}-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/C21H21N3O3/c1-13-9-10-17(11-14(13)2)24-20(26)18(19(25)23-21(24)27)12-22-15(3)16-7-5-4-6-8-16/h4-12,15,22H,1-3H3,(H,23,25,27)/b18-12-
InChIKey KVTDSPBIYMMROZ-PDGQHHTCSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10773
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: E03097; Labnumber: KKA-0212C-0881; SBI_ID: SBI-010776
Synonyms 1-(3,4-dimethylphenyl)-5-{[(1-phenylethyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C