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ANTI-6-METHYL-DELTA-3(3A)-HEXAHYDROBENZO-[B]-THIOPHENE-1,1-DIOXIDE
SpectraBase Compound ID BnXFdEoNmRl
InChI InChI=1S/C9H14O2S/c1-7-2-3-8-4-5-12(10,11)9(8)6-7/h4,7,9H,2-3,5-6H2,1H3
InChIKey SYFYSYJEUSLRKY-UHFFFAOYSA-N
Mol Weight 186.27 g/mol
Molecular Formula C9H14O2S
Exact Mass 186.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANvpZ4bde54
Name SYN-6-METHYL-DELTA-3(3A)-HEXAHYDROBENZO-[B]-THIOPHENE-1,1-DIOXIDE
CAS Registry Number 82149-61-9
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O2S
InChI InChI=1S/C9H14O2S/c1-7-2-3-8-4-5-12(10,11)9(8)6-7/h4,7,9H,2-3,5-6H2,1H3
InChIKey SYFYSYJEUSLRKY-UHFFFAOYSA-N
Literature Reference Author L.D.QUIN,J.E.MACDIARMID
Literature Reference Citation J.ORG.CHEM.,47,3248(1982)
Literature Reference DOI 10.1021/jo00138a009
Molecular Weight 186.269 g/mol
Solvent CDCl3
Source File Reference UWCS12787