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cyclopentyl 4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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cyclopentyl 4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID EcmEvQJp7wd
InChI InChI=1S/C18H19BrN2O5/c1-9-15(17(22)26-10-4-2-3-5-10)16(21-18(23)20-9)11-6-13-14(7-12(11)19)25-8-24-13/h6-7,10,16H,2-5,8H2,1H3,(H2,20,21,23)
InChIKey DWZFWVQWSHHKOT-UHFFFAOYSA-N
Mol Weight 423.26 g/mol
Molecular Formula C18H19BrN2O5
Exact Mass 422.047735 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GIgsK7PTSTF
Name 5-pyrimidinecarboxylic acid, 4-(6-bromo-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, cyclopentyl ester
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/C18H19BrN2O5/c1-9-15(17(22)26-10-4-2-3-5-10)16(21-18(23)20-9)11-6-13-14(7-12(11)19)25-8-24-13/h6-7,10,16H,2-5,8H2,1H3,(H2,20,21,23)
InChIKey DWZFWVQWSHHKOT-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_2725
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: ZI/6014097; Labnumber: SMM-845; IOH_ID: IOH-009728