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2-(3,5-dibromo-1-hydroxy-4-keto-1-cyclohexa-2,5-dienyl)acetamide

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2-(3,5-dibromo-1-hydroxy-4-keto-1-cyclohexa-2,5-dienyl)acetamide
SpectraBase Compound ID KFjvNzH2BUq
InChI InChI=1S/C8H7Br2NO3/c9-4-1-8(14,3-6(11)12)2-5(10)7(4)13/h1-2,14H,3H2,(H2,11,12)
InChIKey OPJJYFWUWHEWDE-UHFFFAOYSA-N
Mol Weight 324.96 g/mol
Molecular Formula C8H7Br2NO3
Exact Mass 322.879269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ufIEvZ17hT
Name 2,6-Dibromo-4-hydroxy-4-acetylamide-2,5-cyclohexadienone
CAS Registry Number 17194-81-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H7Br2NO3
InChI InChI=1S/C8H7Br2NO3/c9-4-1-8(14,3-6(11)12)2-5(10)7(4)13/h1-2,14H,3H2,(H2,11,12)
InChIKey OPJJYFWUWHEWDE-UHFFFAOYSA-N
Literature Reference A.A. Tymiak, K.L. Rinehart, J. Am. Chem. Soc. 103, 6763 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD