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4-methyl-1,3-dioxa-2-thiacyclohexane, 2-oxide

View entire compound with spectra: 12 NMR, 1 FTIR, and 3 MS (GC)

4-methyl-1,3-dioxa-2-thiacyclohexane, 2-oxide
SpectraBase Compound ID IPuUfYvxMAh
InChI InChI=1S/C4H8O3S/c1-4-2-3-6-8(5)7-4/h4H,2-3H2,1H3
InChIKey WGMZCGUVEQNCCE-UHFFFAOYSA-N
Mol Weight 136.16 g/mol
Molecular Formula C4H8O3S
Exact Mass 136.019415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5RwPT8oYtSD
Name 4-METHYL-1,3,2-DIOXATHIANE-2-OXIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H8O3S
InChI InChI=1S/C4H8O3S/c1-4-2-3-6-8(5)7-4/h4H,2-3H2,1H3
InChIKey WGMZCGUVEQNCCE-UHFFFAOYSA-N
Literature Reference Author D.G.HELLIER,A.M.PHILLIPS
Literature Reference Citation ORG.MAGN.RES.,18,178(1982)
Literature Reference DOI 10.1002/mrc.1270180314
Molecular Weight 136.166 g/mol
Solvent CDCl3
Source File Reference UNIW1767