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(5E)-5-({[2-(dimethylamino)ethyl]amino}methylene)-1-(4-iodophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 7JJ5GiG9QHb
InChI InChI=1S/C15H17IN4O3/c1-19(2)8-7-17-9-12-13(21)18-15(23)20(14(12)22)11-5-3-10(16)4-6-11/h3-6,9,17H,7-8H2,1-2H3,(H,18,21,23)/b12-9+
InChIKey KTEGZKMNCYAKNK-FMIVXFBMSA-N
Mol Weight 428.23 g/mol
Molecular Formula C15H17IN4O3
Exact Mass 428.034535 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GWJKkE6lmzk
Name (5E)-5-({[2-(dimethylamino)ethyl]amino}methylene)-1-(4-iodophenyl)-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/C15H17IN4O3/c1-19(2)8-7-17-9-12-13(21)18-15(23)20(14(12)22)11-5-3-10(16)4-6-11/h3-6,9,17H,7-8H2,1-2H3,(H,18,21,23)/b12-9+
InChIKey KTEGZKMNCYAKNK-FMIVXFBMSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15153
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: C29835; Labnumber: KKA-9909-11178; SBI_ID: SBI-015156
Synonyms 5-({[2-(dimethylamino)ethyl]amino}methylene)-1-(4-iodophenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C