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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1,3-benzodioxol-5-ylmethylene)-1-(4-methylphenyl)-, (5E)-
SpectraBase Compound ID 43OL4kzQDba
InChI InChI=1S/C19H14N2O5/c1-11-2-5-13(6-3-11)21-18(23)14(17(22)20-19(21)24)8-12-4-7-15-16(9-12)26-10-25-15/h2-9H,10H2,1H3,(H,20,22,24)/b14-8+
InChIKey WXCPVQPBCWENCR-RIYZIHGNSA-N
Mol Weight 350.33 g/mol
Molecular Formula C19H14N2O5
Exact Mass 350.090272 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8UJN3jJVpjq
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1,3-benzodioxol-5-ylmethylene)-1-(4-methylphenyl)-, (5E)-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.090271554 u
Formula C19H14N2O5
InChI InChI=1S/C19H14N2O5/c1-11-2-5-13(6-3-11)21-18(23)14(17(22)20-19(21)24)8-12-4-7-15-16(9-12)26-10-25-15/h2-9H,10H2,1H3,(H,20,22,24)/b14-8+
InChIKey WXCPVQPBCWENCR-RIYZIHGNSA-N
Molecular Weight 350.330 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8204
Solvent DMSO-d6
Source Vendor ID: NMR/9253438; Lab Info: LP; Lab Number: LP-0010843
Temperature 29.85 °C