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1-[3-(4-bromophenyl)-2-oxopropyl]-3-[4-(furan-2-yl)-2-oxobutyl]-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione
SpectraBase Compound ID 6f5YVjq1PlB
InChI InChI=1S/C21H17BrN4O5S/c22-13-3-5-14(6-4-13)24-18(28)12-25-16-7-9-32-19(16)20(29)26(21(25)30)11-17(27)23-10-15-2-1-8-31-15/h1-9H,10-12H2,(H,23,27)(H,24,28)
InChIKey BLAJWMDOVWPUPX-UHFFFAOYSA-N
Mol Weight 517.35 g/mol
Molecular Formula C21H17BrN4O5S
Exact Mass 516.010304 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 67Ki5slFjYp
Name 1-[3-(4-bromophenyl)-2-oxopropyl]-3-[4-(furan-2-yl)-2-oxobutyl]-1H,2H,3H,4H-thieno[3,2-d]pyrimidine-2,4-dione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 516.010303832 u
Formula C21H17BrN4O5S
InChI InChI=1S/C21H17BrN4O5S/c22-13-3-5-14(6-4-13)24-18(28)12-25-16-7-9-32-19(16)20(29)26(21(25)30)11-17(27)23-10-15-2-1-8-31-15/h1-9H,10-12H2,(H,23,27)(H,24,28)
InChIKey BLAJWMDOVWPUPX-UHFFFAOYSA-N
Molecular Weight 517.354 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8326
Solvent DMSO-d6
Source Vendor ID: NMR/13219454