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Bicyclo(2.2.2)octan-2-one
SpectraBase Compound ID 1dAE1qeupi8
InChI InChI=1S/C8H12O/c9-8-5-6-1-3-7(8)4-2-6/h6-7H,1-5H2
InChIKey VEPYQCZRVLNDBC-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5fGT5mX19A1
Name Bicyclo(2.2.2)octan-2-one
CAS Registry Number 2716-23-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c9-8-5-6-1-3-7(8)4-2-6/h6-7H,1-5H2
InChIKey VEPYQCZRVLNDBC-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference J.B. Stothers, C.T.Tan, Can. J. Chem. 54, 917 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3