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3-Acetyl-4-methyltetrahydrothiopyran-4-ol

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3-Acetyl-4-methyltetrahydrothiopyran-4-ol
SpectraBase Compound ID 9McrS6BJCH7
InChI InChI=1S/C8H14O2S/c1-6(9)7-5-11-4-3-8(7,2)10/h7,10H,3-5H2,1-2H3
InChIKey ZGBLOLRGALMFIP-UHFFFAOYSA-N
Mol Weight 174.26 g/mol
Molecular Formula C8H14O2S
Exact Mass 174.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OOK4iaJoSj
Name Epi-3-acetyl-4-methyl-tetrahydrothiopyran-4-ol
CAS Registry Number 75732-00-2
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H14O2S
InChI InChI=1S/C8H14O2S/c1-6(9)7-5-11-4-3-8(7,2)10/h7,10H,3-5H2,1-2H3
InChIKey ZGBLOLRGALMFIP-UHFFFAOYSA-N
Instrument Name SF = 060 MHz
Literature Reference J. Org. Chem. 46, 128 (1981).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3