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trans-2-ISOPROPYL-5-(METHYLTHIO)-m-DIOXANE
SpectraBase Compound ID 8ui3FGzgmO9
InChI InChI=1S/C8H16O2S/c1-6(2)8-9-4-7(11-3)5-10-8/h6-8H,4-5H2,1-3H3
InChIKey OYAOEDBUVKRELZ-UHFFFAOYSA-N
Mol Weight 176.27 g/mol
Molecular Formula C8H16O2S
Exact Mass 176.087101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B2k9lVtgdVM
Name cis-5-Methylthio-2-isopropyl-1,3-dioxane
CAS Registry Number 40245-27-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H16O2S
InChI InChI=1S/C8H16O2S/c1-6(2)8-9-4-7(11-3)5-10-8/h6-8H,4-5H2,1-3H3
InChIKey OYAOEDBUVKRELZ-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference E.L. Eliel, D. Kandasamy, R.C. Sechrest, J. Org. Chem. 42, 1533 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3