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2-tert-Butyl-2,5,5-trimethyl-1,3-dithiane
SpectraBase Compound ID D1shIQhKbcB
InChI InChI=1S/C11H22S2/c1-9(2,3)11(6)12-7-10(4,5)8-13-11/h7-8H2,1-6H3
InChIKey IFIGNJHRGIIIFB-UHFFFAOYSA-N
Mol Weight 218.42 g/mol
Molecular Formula C11H22S2
Exact Mass 218.116293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dq583B4doY4
Name 2-tert-Butyl-2,5,5-trimethyl-1,3-dithiane
CAS Registry Number 60311-44-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H22S2
InChI InChI=1S/C11H22S2/c1-9(2,3)11(6)12-7-10(4,5)8-13-11/h7-8H2,1-6H3
InChIKey IFIGNJHRGIIIFB-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference E.L. Eliel, V.S. Rao, F.G. Riddell, J. Am. Chem. Soc. 98, 3583 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3