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(E)-(4,4,6-TRIMETHYL-7-OXABICYCLO-[4.1.0]-HEPT-2-YLIDEN)-ESSIGSAEURE-ETHYLESTER
SpectraBase Compound ID IFqAeNhsXqr
InChI InChI=1S/C13H20O3/c1-5-15-10(14)6-9-7-12(2,3)8-13(4)11(9)16-13/h6,11H,5,7-8H2,1-4H3/b9-6+
InChIKey GBXLKNPYJAGEHO-RMKNXTFCSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfCUVLVLY3W
Name (E)-(3,5,5-Trimethyl-2,3-epoxy-cyclohexylidene)-acetic acid, ethyl ester
CAS Registry Number 71055-34-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-5-15-10(14)6-9-7-12(2,3)8-13(4)11(9)16-13/h6,11H,5,7-8H2,1-4H3/b9-6+
InChIKey GBXLKNPYJAGEHO-RMKNXTFCSA-N
Instrument Name Varian CFT-20
Literature Reference N. Bensel, J. Hoehn, H. Marschall, Chem. Ber. 112, 2256 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3