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3-Methyl-bicyclo(2.2.2)octan-2-one
SpectraBase Compound ID AjfHdXxcIal
InChI InChI=1S/C9H14O/c1-6-7-2-4-8(5-3-7)9(6)10/h6-8H,2-5H2,1H3
InChIKey RMZQBMVYJTYCBD-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86gLA0i3OCx
Name 3-Methyl-bicyclo(2.2.2)octan-2-one
CAS Registry Number 26051-25-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-6-7-2-4-8(5-3-7)9(6)10/h6-8H,2-5H2,1H3
InChIKey RMZQBMVYJTYCBD-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 44, 1184 (1979).
NMR Standard not reported
Observed nucleus 17O
Solvent Dioxane