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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1,3-benzodioxol-5-ylmethylene)-1-[(4-methoxyphenyl)methyl]-, (5E)-
SpectraBase Compound ID 6Ilk87bkHdV
InChI InChI=1S/C20H16N2O6/c1-26-14-5-2-12(3-6-14)10-22-19(24)15(18(23)21-20(22)25)8-13-4-7-16-17(9-13)28-11-27-16/h2-9H,10-11H2,1H3,(H,21,23,25)/b15-8+
InChIKey JTVBLQYVMYWICV-OVCLIPMQSA-N
Mol Weight 380.36 g/mol
Molecular Formula C20H16N2O6
Exact Mass 380.100836 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AKxu8XwDEbU
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1,3-benzodioxol-5-ylmethylene)-1-[(4-methoxyphenyl)methyl]-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.100836237 u
Formula C20H16N2O6
InChI InChI=1S/C20H16N2O6/c1-26-14-5-2-12(3-6-14)10-22-19(24)15(18(23)21-20(22)25)8-13-4-7-16-17(9-13)28-11-27-16/h2-9H,10-11H2,1H3,(H,21,23,25)/b15-8+
InChIKey JTVBLQYVMYWICV-OVCLIPMQSA-N
Molecular Weight 380.356 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5853
Solvent DMSO-d6
Source Vendor ID: NMR/9223945; Lab Info: LP; Lab Number: LP-0020587