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5-bromo-1-[(4-propoxyphenyl)sulfonyl]-2,4(1H,3H)-pyrimidinedione
SpectraBase Compound ID JKuz0nVSado
InChI InChI=1S/C13H13BrN2O5S/c1-2-7-21-9-3-5-10(6-4-9)22(19,20)16-8-11(14)12(17)15-13(16)18/h3-6,8H,2,7H2,1H3,(H,15,17,18)
InChIKey KDYGQGXSXKSUEN-UHFFFAOYSA-N
Mol Weight 389.22 g/mol
Molecular Formula C13H13BrN2O5S
Exact Mass 387.972856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5bThI1CJmIn
Name 5-bromo-1-[(4-propoxyphenyl)sulfonyl]-2,4(1H,3H)-pyrimidinedione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.972855696 u
Formula C13H13BrN2O5S
InChI InChI=1S/C13H13BrN2O5S/c1-2-7-21-9-3-5-10(6-4-9)22(19,20)16-8-11(14)12(17)15-13(16)18/h3-6,8H,2,7H2,1H3,(H,15,17,18)
InChIKey KDYGQGXSXKSUEN-UHFFFAOYSA-N
Molecular Weight 389.220 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1804
Solvent DMSO-d6
Source Vendor ID: NMR/12278454