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2-(3-Methoxycarbonyl-butyl)-3,3,4-trimethyl-cyclohexanone

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2-(3-Methoxycarbonyl-butyl)-3,3,4-trimethyl-cyclohexanone
SpectraBase Compound ID 1aoypT13eze
InChI InChI=1S/C15H26O3/c1-10(14(17)18-5)6-8-12-13(16)9-7-11(2)15(12,3)4/h10-12H,6-9H2,1-5H3
InChIKey VAWHXAMQTDWBBH-UHFFFAOYSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5nue99rlxI3
Name 2-(3-Methoxycarbonyl-butyl)-3,3,4-trimethyl-cyclohexanone
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-10(14(17)18-5)6-8-12-13(16)9-7-11(2)15(12,3)4/h10-12H,6-9H2,1-5H3
InChIKey VAWHXAMQTDWBBH-UHFFFAOYSA-N
Instrument Name SF = 500 MHz
Literature Reference Z. Huang, Cd. Poulter, F.R.Wolf, J. Am. Chem. Soc. 110, 3959 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3