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(5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 9BDgTvSCRlb
InChI InChI=1S/C19H25N5O3/c25-17-16(13-20-8-4-10-23-12-9-21-14-23)18(26)24(19(27)22-17)11-7-15-5-2-1-3-6-15/h5,9,12-14,20H,1-4,6-8,10-11H2,(H,22,25,27)/b16-13+
InChIKey GNGCQAUATOUEKH-DTQAZKPQSA-N
Mol Weight 371.44 g/mol
Molecular Formula C19H25N5O3
Exact Mass 371.19574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6nNLSWMLoBL
Name (5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(1H-imidazol-1-yl)propyl]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/C19H25N5O3/c25-17-16(13-20-8-4-10-23-12-9-21-14-23)18(26)24(19(27)22-17)11-7-15-5-2-1-3-6-15/h5,9,12-14,20H,1-4,6-8,10-11H2,(H,22,25,27)/b16-13+
InChIKey GNGCQAUATOUEKH-DTQAZKPQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17542
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: D28648; Labnumber: KKA-0211-0403; SBI_ID: SBI-017545
Synonyms 1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C