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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1,3-benzodioxol-5-ylmethylene)-1-methyl-, (5E)-
SpectraBase Compound ID GeZEYAsqFAn
InChI InChI=1S/C13H10N2O5/c1-15-12(17)8(11(16)14-13(15)18)4-7-2-3-9-10(5-7)20-6-19-9/h2-5H,6H2,1H3,(H,14,16,18)/b8-4+
InChIKey YYINFXRUJFVXOC-XBXARRHUSA-N
Mol Weight 274.23 g/mol
Molecular Formula C13H10N2O5
Exact Mass 274.058971 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jhk3ycDCxZn
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-(1,3-benzodioxol-5-ylmethylene)-1-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 274.058971425 u
Formula C13H10N2O5
InChI InChI=1S/C13H10N2O5/c1-15-12(17)8(11(16)14-13(15)18)4-7-2-3-9-10(5-7)20-6-19-9/h2-5H,6H2,1H3,(H,14,16,18)/b8-4+
InChIKey YYINFXRUJFVXOC-XBXARRHUSA-N
Molecular Weight 274.232 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5861
Solvent DMSO-d6
Source Vendor ID: NMR/9223986; Lab Info: LP; Lab Number: LP-0020221