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TRANS-2-ISOPROPYL-5-METHYLSULPHONYL-1,3-DIOXANE
SpectraBase Compound ID GKeRZLfZwPM
InChI InChI=1S/C8H16O4S/c1-6(2)8-11-4-7(5-12-8)13(3,9)10/h6-8H,4-5H2,1-3H3/t7-,8-
InChIKey VCIDEYFOECSAJW-ZKCHVHJHSA-N
Mol Weight 208.27 g/mol
Molecular Formula C8H16O4S
Exact Mass 208.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AdocIfhEBg4
Name trans-2-Isopropyl-5-methylsulfonyl-1,3-dioxane
CAS Registry Number 40245-34-9
Comments IN ACETONE-D6/CDCL3 1/1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H16O4S
InChI InChI=1S/C8H16O4S/c1-6(2)8-11-4-7(5-12-8)13(3,9)10/h6-8H,4-5H2,1-3H3/t7-,8-
InChIKey VCIDEYFOECSAJW-ZKCHVHJHSA-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 Mixture