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(5E)-1-(4-methoxyphenyl)-5-{[(4-methyl-1-piperazinyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 2k8OPflJSTz
InChI InChI=1S/C17H21N5O4/c1-20-7-9-21(10-8-20)18-11-14-15(23)19-17(25)22(16(14)24)12-3-5-13(26-2)6-4-12/h3-6,11,18H,7-10H2,1-2H3,(H,19,23,25)/b14-11+
InChIKey PSOFVMWZZKJJDM-SDNWHVSQSA-N
Mol Weight 359.39 g/mol
Molecular Formula C17H21N5O4
Exact Mass 359.159354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BeYZX5Cygch
Name (5E)-1-(4-methoxyphenyl)-5-{[(4-methyl-1-piperazinyl)amino]methylene}-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/C17H21N5O4/c1-20-7-9-21(10-8-20)18-11-14-15(23)19-17(25)22(16(14)24)12-3-5-13(26-2)6-4-12/h3-6,11,18H,7-10H2,1-2H3,(H,19,23,25)/b14-11+
InChIKey PSOFVMWZZKJJDM-SDNWHVSQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17547
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: D28656; Labnumber: KKA-0211-0736; SBI_ID: SBI-017550
Synonyms 1-(4-methoxyphenyl)-5-{[(4-methyl-1-piperazinyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C