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(5E)-5-({[2-(1-cyclohexen-1-yl)ethyl]amino}methylene)-1-(3,4-dimethylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID CEdCWFvggiZ
InChI InChI=1S/C21H25N3O3/c1-14-8-9-17(12-15(14)2)24-20(26)18(19(25)23-21(24)27)13-22-11-10-16-6-4-3-5-7-16/h6,8-9,12-13,22H,3-5,7,10-11H2,1-2H3,(H,23,25,27)/b18-13+
InChIKey RFWHKNDDAKMOOV-QGOAFFKASA-N
Mol Weight 367.45 g/mol
Molecular Formula C21H25N3O3
Exact Mass 367.189592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BPcjGe0ALis
Name (5E)-5-({[2-(1-cyclohexen-1-yl)ethyl]amino}methylene)-1-(3,4-dimethylphenyl)-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/C21H25N3O3/c1-14-8-9-17(12-15(14)2)24-20(26)18(19(25)23-21(24)27)13-22-11-10-16-6-4-3-5-7-16/h6,8-9,12-13,22H,3-5,7,10-11H2,1-2H3,(H,23,25,27)/b18-13+
InChIKey RFWHKNDDAKMOOV-QGOAFFKASA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10707
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: E02898; Labnumber: KKA-0211-3743; SBI_ID: SBI-010710
Synonyms 5-({[2-(1-cyclohexen-1-yl)ethyl]amino}methylene)-1-(3,4-dimethylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C