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thioacetic acid, anhydrosulfide

View entire compound with spectra: 5 NMR, 3 FTIR, and 1 MS (GC)

thioacetic acid, anhydrosulfide
SpectraBase Compound ID 9tdMMH3F6ng
InChI InChI=1S/C4H6O2S/c1-3(5)7-4(2)6/h1-2H3
InChIKey DPCQJLQPDJPRCM-UHFFFAOYSA-N
Mol Weight 118.15 g/mol
Molecular Formula C4H6O2S
Exact Mass 118.008851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1xwBRTHJ8q4
Name DIACETYLSULFID
CAS Registry Number 3232-39-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H6O2S
InChI InChI=1S/C4H6O2S/c1-3(5)7-4(2)6/h1-2H3
InChIKey DPCQJLQPDJPRCM-UHFFFAOYSA-N
Literature Reference Author C.M.HALL,J.WEMPLE
Literature Reference Citation J.ORG.CHEM.,42,2118(1977)
Literature Reference DOI 10.1021/jo00432a021
Molecular Weight 118.150 g/mol
Solvent CDCl3
Source File Reference UNIW13336