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2,2-Dimethyl-1,3-dithiane

View entire compound with spectra: 22 NMR, and 4 MS (GC)

2,2-Dimethyl-1,3-dithiane
SpectraBase Compound ID IBxgYE5Pwuq
InChI InChI=1S/C6H12S2/c1-6(2)7-4-3-5-8-6/h3-5H2,1-2H3
InChIKey YRFVUSVRBICMRJ-UHFFFAOYSA-N
Mol Weight 148.28 g/mol
Molecular Formula C6H12S2
Exact Mass 148.038043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3t2jeYLVrt5
Name 2,2-Dimethyl-1,3-dithiane
CAS Registry Number 6007-22-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H12S2
InChI InChI=1S/C6H12S2/c1-6(2)7-4-3-5-8-6/h3-5H2,1-2H3
InChIKey YRFVUSVRBICMRJ-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