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acetic acid, [2-bromo-6-chloro-4-[(Z)-(1-(4-ethoxyphenyl)tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)methyl]phenoxy]-
SpectraBase Compound ID DmjsLyis9H2
InChI InChI=1S/C21H16BrClN2O7/c1-2-31-13-5-3-12(4-6-13)25-20(29)14(19(28)24-21(25)30)7-11-8-15(22)18(16(23)9-11)32-10-17(26)27/h3-9H,2,10H2,1H3,(H,26,27)(H,24,28,30)/b14-7-
InChIKey SBWHLEOAGHGWFB-AUWJEWJLSA-N
Mol Weight 523.72 g/mol
Molecular Formula C21H16BrClN2O7
Exact Mass 521.982942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1BRr6WHvWwu
Name acetic acid, [2-bromo-6-chloro-4-[(Z)-(1-(4-ethoxyphenyl)tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)methyl]phenoxy]-
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/C21H16BrClN2O7/c1-2-31-13-5-3-12(4-6-13)25-20(29)14(19(28)24-21(25)30)7-11-8-15(22)18(16(23)9-11)32-10-17(26)27/h3-9H,2,10H2,1H3,(H,26,27)(H,24,28,30)/b14-7-
InChIKey SBWHLEOAGHGWFB-AUWJEWJLSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6939
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: NMR/12228321