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3-(2,6-Dibromo-benzoyl)-2-butyl-benzofuran
SpectraBase Compound ID GWxTM6AcYhO
InChI InChI=1S/C19H16Br2O2/c1-2-3-10-16-17(12-7-4-5-11-15(12)23-16)19(22)18-13(20)8-6-9-14(18)21/h4-9,11H,2-3,10H2,1H3
InChIKey ZWYDTAAFJBABJG-UHFFFAOYSA-N
Mol Weight 436.14 g/mol
Molecular Formula C19H16Br2O2
Exact Mass 433.951706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CEnfZYz4edc
Name 3-(2,6-Dibromo-benzoyl)-2-butyl-benzofuran
CAS Registry Number 112363-29-8
Comments O-CIS CONFORMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H16Br2O2
InChI InChI=1S/C19H16Br2O2/c1-2-3-10-16-17(12-7-4-5-11-15(12)23-16)19(22)18-13(20)8-6-9-14(18)21/h4-9,11H,2-3,10H2,1H3
InChIKey ZWYDTAAFJBABJG-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference R.J. Abraham, P.E. Smith, C. Deleuze, Magn. Res. Chem. 25, 147 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3