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(5E)-5-(3,5-dibromo-2-methoxybenzylidene)-1-[2-(4-fluorophenyl)ethyl]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 9Jkhjxi57uP
InChI InChI=1S/C20H15Br2FN2O4/c1-29-17-12(8-13(21)10-16(17)22)9-15-18(26)24-20(28)25(19(15)27)7-6-11-2-4-14(23)5-3-11/h2-5,8-10H,6-7H2,1H3,(H,24,26,28)/b15-9+
InChIKey NSUPYGWEVUTKAS-OQLLNIDSSA-N
Mol Weight 526.16 g/mol
Molecular Formula C20H15Br2FN2O4
Exact Mass 523.938261 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EqslhT5P7e1
Name (5E)-5-(3,5-dibromo-2-methoxybenzylidene)-1-[2-(4-fluorophenyl)ethyl]-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/C20H15Br2FN2O4/c1-29-17-12(8-13(21)10-16(17)22)9-15-18(26)24-20(28)25(19(15)27)7-6-11-2-4-14(23)5-3-11/h2-5,8-10H,6-7H2,1H3,(H,24,26,28)/b15-9+
InChIKey NSUPYGWEVUTKAS-OQLLNIDSSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8957
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: D40081; Labnumber: KKA001-0001513-1; SBI_ID: SBI-008960
Synonyms 5-(3,5-dibromo-2-methoxybenzylidene)-1-[2-(4-fluorophenyl)ethyl]-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C