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4-Acetoxy-2,6,6,G-tetramethyl-1-cyclohexen-pent-1-yn-3-enol acetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-Acetoxy-2,6,6,G-tetramethyl-1-cyclohexen-pent-1-yn-3-enol acetate
SpectraBase Compound ID 6O3bvb8Avzs
InChI InChI=1S/C19H26O4/c1-13(9-10-22-15(3)20)7-8-18-14(2)11-17(23-16(4)21)12-19(18,5)6/h9,17H,10-12H2,1-6H3/b13-9+
InChIKey VTWIPBUIGMOKBO-UKTHLTGXSA-N
Mol Weight 318.41 g/mol
Molecular Formula C19H26O4
Exact Mass 318.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3IflU5JczBp
Name 4-Acetoxy-2,6,6,G-tetramethyl-1-cyclohexen-pent-1-yn-3-enol acetate
CAS Registry Number 70905-69-0
Comments WHE-7331-42
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H26O4
InChI InChI=1S/C19H26O4/c1-13(9-10-22-15(3)20)7-8-18-14(2)11-17(23-16(4)21)12-19(18,5)6/h9,17H,10-12H2,1-6H3/b13-9+
InChIKey VTWIPBUIGMOKBO-UKTHLTGXSA-N
Instrument Name Bruker WH-360
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3