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1-Acetoxy-2,2,6,6-tetramethyl-cyclohexane
SpectraBase Compound ID 1SB60JmB1D7
InChI InChI=1S/C12H22O2/c1-9(13)14-10-11(2,3)7-6-8-12(10,4)5/h10H,6-8H2,1-5H3
InChIKey HVRWVQADKGNVGB-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HMKePUOh7n
Name 1-Acetoxy-2,2,6,6-tetramethyl-cyclohexane
CAS Registry Number 69582-61-2
Comments ACETOXY=E,C-7 AND C-10 = E, C-8 AND C-9 = A*
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-9(13)14-10-11(2,3)7-6-8-12(10,4)5/h10H,6-8H2,1-5H3
InChIKey HVRWVQADKGNVGB-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference H.J. Schneider, W. Freitag, Chem. Ber. 112, 16 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl3F