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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylene]-1-methyl-, (5Z)-
SpectraBase Compound ID 8zsaKxfQwzT
InChI InChI=1S/C13H11IN2O5/c1-16-12(19)7(11(18)15-13(16)20)3-6-4-8(14)10(17)9(5-6)21-2/h3-5,17H,1-2H3,(H,15,18,20)/b7-3-
InChIKey LNZKYMWPACKUFT-CLTKARDFSA-N
Mol Weight 402.14 g/mol
Molecular Formula C13H11IN2O5
Exact Mass 401.971266 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KbfQOKGUfeB
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylene]-1-methyl-, (5Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.971266457 u
Formula C13H11IN2O5
InChI InChI=1S/C13H11IN2O5/c1-16-12(19)7(11(18)15-13(16)20)3-6-4-8(14)10(17)9(5-6)21-2/h3-5,17H,1-2H3,(H,15,18,20)/b7-3-
InChIKey LNZKYMWPACKUFT-CLTKARDFSA-N
Molecular Weight 402.144 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6409
Solvent DMSO-d6
Source Vendor ID: NMR/9253499; Lab Info: LP; Lab Number: LP-0020195