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(5Z)-5-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]amino}methylene)-1-(4-methoxyphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID EITimvAXwJV
InChI InChI=1S/C16H19N3O7/c1-26-11-4-2-10(3-5-11)19-14(24)12(13(23)18-15(19)25)6-17-16(7-20,8-21)9-22/h2-6,17,20-22H,7-9H2,1H3,(H,18,23,25)/b12-6-
InChIKey KGDRYRNPXBOJKW-SDQBBNPISA-N
Mol Weight 365.34 g/mol
Molecular Formula C16H19N3O7
Exact Mass 365.1223 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5b6knbezHN1
Name (5Z)-5-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]amino}methylene)-1-(4-methoxyphenyl)-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/C16H19N3O7/c1-26-11-4-2-10(3-5-11)19-14(24)12(13(23)18-15(19)25)6-17-16(7-20,8-21)9-22/h2-6,17,20-22H,7-9H2,1H3,(H,18,23,25)/b12-6-
InChIKey KGDRYRNPXBOJKW-SDQBBNPISA-N
NMR Offset 18.2243
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5583
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: D23062; Labnumber: KVEX-20019; SBI_ID: SBI-005585
Synonyms 5-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]amino}methylene)-1-(4-methoxyphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C