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1-Thiacyclooctanone-5;5-thiocanone

View entire compound with spectra: 4 NMR, and 1 FTIR

1-Thiacyclooctanone-5;5-thiocanone
SpectraBase Compound ID 5P7XMprV2ZR
InChI InChI=1S/C7H12OS/c8-7-3-1-5-9-6-2-4-7/h1-6H2
InChIKey JEAURVWXXNRTKE-UHFFFAOYSA-N
Mol Weight 144.23 g/mol
Molecular Formula C7H12OS
Exact Mass 144.060886 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Wp0hYjxPkO
Name 1-THIACYCLOOCTANONE-5;5-THIOCANONE
CAS Registry Number 20701-80-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12OS
InChI InChI=1S/C7H12OS/c8-7-3-1-5-9-6-2-4-7/h1-6H2
InChIKey JEAURVWXXNRTKE-UHFFFAOYSA-N
Literature Reference Author H.DAHN,H.P.SCHLUNKE,J.TEMLER
Literature Reference Citation HELV.CHIM.ACTA,55,907(1972)
Literature Reference DOI 10.1002/hlca.19720550316
Solvent DIOXANE:H2O=8:1
Source File Reference UNIO95