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ethyl 4-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-2-oxo-6-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID Fjc7VzyH5F8
InChI InChI=1S/C19H22BrN3O5/c1-4-6-13-15(18(24)27-5-2)16(23-19(25)22-13)11-9-12(20)17(28-8-7-21)14(10-11)26-3/h9-10,16H,4-6,8H2,1-3H3,(H2,22,23,25)
InChIKey VPEDMEZQIRVTEF-UHFFFAOYSA-N
Mol Weight 452.31 g/mol
Molecular Formula C19H22BrN3O5
Exact Mass 451.074284 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Eu1K0UDAyE1
Name ethyl 4-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-2-oxo-6-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
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/C19H22BrN3O5/c1-4-6-13-15(18(24)27-5-2)16(23-19(25)22-13)11-9-12(20)17(28-8-7-21)14(10-11)26-3/h9-10,16H,4-6,8H2,1-3H3,(H2,22,23,25)
InChIKey VPEDMEZQIRVTEF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31731
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: 1843273; SBI_ID: SBI-031735
Temperature 308 °C