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1,3-Dimethyl-3-acetoxy-bicyclo(2.2.2)octa-5,7-dien-2-one
SpectraBase Compound ID Ke8pUHeMmZw
InChI InChI=1S/C12H14O3/c1-8(13)15-12(3)9-4-6-11(2,7-5-9)10(12)14/h4-7,9H,1-3H3
InChIKey DPNRLPIEVQCNKX-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3AxizHlFKrj
Name 1,3-Dimethyl-3-acetoxy-bicyclo(2.2.2)octa-5,7-dien-2-one
CAS Registry Number 78599-31-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-8(13)15-12(3)9-4-6-11(2,7-5-9)10(12)14/h4-7,9H,1-3H3
InChIKey DPNRLPIEVQCNKX-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