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(5Z)-1-[4-(1-adamantyl)phenyl]-5-(3-ethoxy-4-methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID La17JtQlKO8
InChI InChI=1S/C30H32N2O5/c1-3-37-26-14-18(4-9-25(26)36-2)13-24-27(33)31-29(35)32(28(24)34)23-7-5-22(6-8-23)30-15-19-10-20(16-30)12-21(11-19)17-30/h4-9,13-14,19-21H,3,10-12,15-17H2,1-2H3,(H,31,33,35)/b24-13-/t19-,20+,21-,30-
InChIKey JDXSSMXYZWWTRP-YPRAHHFFSA-N
Mol Weight 500.6 g/mol
Molecular Formula C30H32N2O5
Exact Mass 500.231122 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gw2vDBve4R6
Name (5Z)-1-[4-(1-adamantyl)phenyl]-5-(3-ethoxy-4-methoxybenzylidene)-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/C30H32N2O5/c1-3-37-26-14-18(4-9-25(26)36-2)13-24-27(33)31-29(35)32(28(24)34)23-7-5-22(6-8-23)30-15-19-10-20(16-30)12-21(11-19)17-30/h4-9,13-14,19-21H,3,10-12,15-17H2,1-2H3,(H,31,33,35)/b24-13-/t19-,20+,21-,30-
InChIKey JDXSSMXYZWWTRP-YPRAHHFFSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16940
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: UZI/8196981; UBI_ID: UBI-016943
Synonyms 1-[4-(1-adamantyl)phenyl]-5-(3-ethoxy-4-methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C