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1,3-Dimethyl-3-acetoxy-bicyclo(2.2.2)octan-2-one

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1,3-Dimethyl-3-acetoxy-bicyclo(2.2.2)octan-2-one
SpectraBase Compound ID W1TY6867NW
InChI InChI=1S/C12H18O3/c1-8(13)15-12(3)9-4-6-11(2,7-5-9)10(12)14/h9H,4-7H2,1-3H3
InChIKey ATBBAWXTEVMBNI-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3aBXntsarhq
Name 1,3-Dimethyl-3-acetoxy-bicyclo(2.2.2)octan-2-one
CAS Registry Number 77130-91-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8(13)15-12(3)9-4-6-11(2,7-5-9)10(12)14/h9H,4-7H2,1-3H3
InChIKey ATBBAWXTEVMBNI-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference G.E. Langford, H. Auksi, J.A. Gosbee, Tetrahedron 37, 1091 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3