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3,3-Dimethyl.gamma.-sultine
SpectraBase Compound ID AVzjYRGN27Z
InChI InChI=1S/C5H8O2S/c1-5(2)3-4-8(6)7-5/h3-4H,1-2H3
InChIKey NXIBHXQHXAJMRB-UHFFFAOYSA-N
Mol Weight 132.18 g/mol
Molecular Formula C5H8O2S
Exact Mass 132.024501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ld6ltbe0xYJ
Name 3,3-Dimethyl.gamma.-sultine
CAS Registry Number 62024-58-2
Comments SHIFT OF 100.48 PPM FOR C3 MUST BE IN ERROR (WRONG STRUCTURE ?)
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Formula C5H8O2S
InChI InChI=1S/C5H8O2S/c1-5(2)3-4-8(6)7-5/h3-4H,1-2H3
InChIKey NXIBHXQHXAJMRB-UHFFFAOYSA-N
Literature Reference S. Brauerman, D. Reisman, J. Am. Chem. Soc. 99, 605 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3