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3,6-Di-tert-butyl-2,3,7,7-tetramethyl-1,5-octadien-4-one

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3,6-Di-tert-butyl-2,3,7,7-tetramethyl-1,5-octadien-4-one
SpectraBase Compound ID DIR3y35lqr4
InChI InChI=1S/C20H36O/c1-14(2)20(12,19(9,10)11)16(21)13-15(17(3,4)5)18(6,7)8/h13H,1H2,2-12H3
InChIKey MGPHFHMYLAKEQL-UHFFFAOYSA-N
Mol Weight 292.5 g/mol
Molecular Formula C20H36O
Exact Mass 292.276616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JdsYmqgMhyJ
Name 3,6-Di-tert-butyl-2,3,7,7-tetramethyl-1,5-octadien-4-one
CAS Registry Number 108296-93-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H36O
InChI InChI=1S/C20H36O/c1-14(2)20(12,19(9,10)11)16(21)13-15(17(3,4)5)18(6,7)8/h13H,1H2,2-12H3
InChIKey MGPHFHMYLAKEQL-UHFFFAOYSA-N
Literature Reference J.K. Crandall, G.E. Salazar, R.J. Watkins, J. Am. Chem. Soc. 109, 4338 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3