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trans-2-ISOPROPYL-5-(METHYLTHIO)-m-DIOXANE

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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 5a6uz3gZCAK
Name cis-2-ISOPROPYL-5-(METHYLTHIO)-m-DIOXANE
Source of Sample E. L. Eliel, D. Kandasamy, R. C. Sechrest J. Org. Chem. 42, 1533(1977)
CAS Registry Number 40245-27-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Molecular Weight 176.28
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Synonyms M-DIOXANE, 2-ISOPROPYL-5-/METHYLTHIO/-, cis-,