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trans-4-tert-Butyl-cyclohexyl-toluenesulfonate
SpectraBase Compound ID Gfc66R51gR5
InChI InChI=1S/C17H26O3S/c1-13-5-11-16(12-6-13)21(18,19)20-15-9-7-14(8-10-15)17(2,3)4/h5-6,11-12,14-15H,7-10H2,1-4H3
InChIKey JGDVVPFUYCFCOV-UHFFFAOYSA-N
Mol Weight 310.45 g/mol
Molecular Formula C17H26O3S
Exact Mass 310.160266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Sc0L7LCBnK
Name trans-4-tert-Butyl-cyclohexyl-toluenesulfonate
CAS Registry Number 7453-05-6
Comments FOR 1-DEUTERIOCOMPOUND CF.REF. REASSIGNED (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H26O3S
InChI InChI=1S/C17H26O3S/c1-13-5-11-16(12-6-13)21(18,19)20-15-9-7-14(8-10-15)17(2,3)4/h5-6,11-12,14-15H,7-10H2,1-4H3
InChIKey JGDVVPFUYCFCOV-UHFFFAOYSA-N
Instrument Name Bruker WH-270
Literature Reference D. Doddrell, W. Kitching, W. Adcock, J. Org. Chem. 41, 3036 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3