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1-chlorobicyclo[2.2.2]octan-3-one

View entire compound with spectra: 2 NMR

1-chlorobicyclo[2.2.2]octan-3-one
SpectraBase Compound ID IRSs8bn9lqK
InChI InChI=1S/C8H11ClO/c9-8-3-1-6(2-4-8)7(10)5-8/h6H,1-5H2
InChIKey YSTLDJNILJTVGY-UHFFFAOYSA-N
Mol Weight 158.63 g/mol
Molecular Formula C8H11ClO
Exact Mass 158.049843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KMqabJ10Op
Name 4-Chloro-bicyclo(2.2.2)octan-2-one
CAS Registry Number 7697-11-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H11ClO
InChI InChI=1S/C8H11ClO/c9-8-3-1-6(2-4-8)7(10)5-8/h6H,1-5H2
InChIKey YSTLDJNILJTVGY-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference H. Duddeck, P. Wolff, Org. Magn. Resonance 9, 529 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3