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ethyl {5-bromo-2-methoxy-4-[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetate
SpectraBase Compound ID 6Gmny6F6X1D
InChI InChI=1S/C23H21BrN2O7/c1-4-32-20(27)12-33-19-11-17(24)14(10-18(19)31-3)9-16-21(28)25-23(30)26(22(16)29)15-7-5-13(2)6-8-15/h5-11H,4,12H2,1-3H3,(H,25,28,30)/b16-9-
InChIKey ZSPMISRSFCUGCP-SXGWCWSVSA-N
Mol Weight 517.33 g/mol
Molecular Formula C23H21BrN2O7
Exact Mass 516.053214 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6NULugRY6ID
Name ethyl {5-bromo-2-methoxy-4-[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetate
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/C23H21BrN2O7/c1-4-32-20(27)12-33-19-11-17(24)14(10-18(19)31-3)9-16-21(28)25-23(30)26(22(16)29)15-7-5-13(2)6-8-15/h5-11H,4,12H2,1-3H3,(H,25,28,30)/b16-9-
InChIKey ZSPMISRSFCUGCP-SXGWCWSVSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16852
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: UZI/8187322; UBI_ID: UBI-016855
Synonyms ethyl {5-bromo-2-methoxy-4-[(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetate
Temperature 308 °C