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2,2,6,6-Tetramethyl-trans-4-hepten-3-one
SpectraBase Compound ID 2NZQ5iSpoak
InChI InChI=1S/C11H20O/c1-10(2,3)8-7-9(12)11(4,5)6/h7-8H,1-6H3/b8-7+
InChIKey JRTSXIAOCFBBPE-BQYQJAHWSA-N
Mol Weight 168.28 g/mol
Molecular Formula C11H20O
Exact Mass 168.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FbWRCX1nIAN
Name 2,2,6,6-Tetramethyl-trans-4-hepten-3-one
CAS Registry Number 29569-89-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H20O
InChI InChI=1S/C11H20O/c1-10(2,3)8-7-9(12)11(4,5)6/h7-8H,1-6H3/b8-7+
InChIKey JRTSXIAOCFBBPE-BQYQJAHWSA-N
Instrument Name Bruker WH-90
Literature Reference L.E. Overman, L.A. Clizbe, R.L. Freerks, J. Am. Chem. Soc. 103, 2807 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3