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5-Iodo-benzobicyclo(2.2.1)hepten-2-one

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5-Iodo-benzobicyclo(2.2.1)hepten-2-one
SpectraBase Compound ID 100y8pQxddu
InChI InChI=1S/C11H9IO/c12-9-3-1-2-7-8-4-6(11(7)9)5-10(8)13/h1-3,6,8H,4-5H2/t6-,8-/m1/s1
InChIKey YEKYXQAIJSOZRA-HTRCEHHLSA-N
Mol Weight 284.1 g/mol
Molecular Formula C11H9IO
Exact Mass 283.96981 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CesFUsZFimh
Name 5-Iodo-benzobicyclo(2.2.1)hepten-2-one
CAS Registry Number 71925-38-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H9IO
InChI InChI=1S/C11H9IO/c12-9-3-1-2-7-8-4-6(11(7)9)5-10(8)13/h1-3,6,8H,4-5H2/t6-,8-/m1/s1
InChIKey YEKYXQAIJSOZRA-HTRCEHHLSA-N
Instrument Name Bruker WP-80
Literature Reference T.J. Reitz, G.L. Grunewald, Org. Magn. Resonance 21, 596 (1983).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3