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CIS-2-ISOPROPYL-5-METHYLSULPHINYL-1,3-DIOXANE
SpectraBase Compound ID APEbZn5e15V
InChI InChI=1S/C8H16O3S/c1-6(2)8-10-4-7(5-11-8)12(3)9/h6-8H,4-5H2,1-3H3/t7-,8+,12?
InChIKey VAIRFBMWFLJCSQ-ITGSWZIZSA-N
Mol Weight 192.27 g/mol
Molecular Formula C8H16O3S
Exact Mass 192.082016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXayyU1dI3q
Name cis-2-Isopropyl-5-methylsulfinyl-1,3-dioxane
CAS Registry Number 40245-31-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H16O3S
InChI InChI=1S/C8H16O3S/c1-6(2)8-10-4-7(5-11-8)12(3)9/h6-8H,4-5H2,1-3H3/t7-,8+,12?
InChIKey VAIRFBMWFLJCSQ-ITGSWZIZSA-N
Instrument Name Varian XL-100
Literature Reference M. Manoharan, E.L. Eliel, Magn. Res. Chem. 23, 225 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3