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(5E)-5-[(5-Bromo-2-thienyl)methylene]-1-tert-butyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID HYKoo5uWR4U
InChI InChI=1S/C13H13BrN2O3S/c1-13(2,3)16-11(18)8(10(17)15-12(16)19)6-7-4-5-9(14)20-7/h4-6H,1-3H3,(H,15,17,19)/b8-6+
InChIKey CPCYOQACLZHUNG-SOFGYWHQSA-N
Mol Weight 357.22 g/mol
Molecular Formula C13H13BrN2O3S
Exact Mass 355.983026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GAOCahs6Ul5
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(5-bromo-2-thienyl)methylene]-1-(1,1-dimethylethyl)-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.983026458 u
Formula C13H13BrN2O3S
InChI InChI=1S/C13H13BrN2O3S/c1-13(2,3)16-11(18)8(10(17)15-12(16)19)6-7-4-5-9(14)20-7/h4-6H,1-3H3,(H,15,17,19)/b8-6+
InChIKey CPCYOQACLZHUNG-SOFGYWHQSA-N
Molecular Weight 357.222 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6514
Solvent DMSO-d6
Source Vendor ID: NMR/9301130; Lab Info: LP; Lab Number: LP-1701115