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3-METHYLTHIAN

View entire compound with spectra: 10 NMR, and 3 MS (GC)

3-METHYLTHIAN
SpectraBase Compound ID CsKjy7Lg3oj
InChI InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3
InChIKey WTPRCAYZVQKROM-UHFFFAOYSA-N
Mol Weight 116.22 g/mol
Molecular Formula C6H12S
Exact Mass 116.065972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7RO0oazoEv7
Name 3-METHYLTETRAHYDROTHIOPYRAN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H12S
InChI InChI=1S/C6H12S/c1-6-3-2-4-7-5-6/h6H,2-5H2,1H3
InChIKey WTPRCAYZVQKROM-UHFFFAOYSA-N
Literature Reference Author G.BARBARELLA,P.DEMBECH,A.GARBESI,A.FAVA
Literature Reference Citation ORG.MAGN.RES.,8,469(1976)
Literature Reference DOI 10.1002/mrc.1270080908
Molecular Weight 116.221 g/mol
Solvent CDCl3
Source File Reference UNIW2830