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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 4k9MAnfvVtx
Name 4E-Methyl-1,3,2-dioxathiane 2a-oxide
CAS Registry Number 32644-05-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Bruker HX-90
Literature Reference D.G. Hellier, A.M. Phillips, Org. Magn. Resonance 18, 178 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3