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2-(4,4-Dimethyl-1-pentenyl)-2-methyl-1,3-dithiane

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2-(4,4-Dimethyl-1-pentenyl)-2-methyl-1,3-dithiane
SpectraBase Compound ID 4HvlRHwy9Fg
InChI InChI=1S/C12H22S2/c1-11(2,3)7-5-8-12(4)13-9-6-10-14-12/h5,8H,6-7,9-10H2,1-4H3/b8-5+
InChIKey UJXQQTFJNZNBPG-VMPITWQZSA-N
Mol Weight 230.43 g/mol
Molecular Formula C12H22S2
Exact Mass 230.116293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JUybVHWvJMX
Name 2-(4,4-Dimethyl-1-pentenyl)-2-methyl-1,3-dithiane
CAS Registry Number 64087-17-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22S2
InChI InChI=1S/C12H22S2/c1-11(2,3)7-5-8-12(4)13-9-6-10-14-12/h5,8H,6-7,9-10H2,1-4H3/b8-5+
InChIKey UJXQQTFJNZNBPG-VMPITWQZSA-N
Literature Reference D. Seebach, R. Buerstinghaus, Liebigs Ann. Chem. 830 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3