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THIO-1-BUTANESULFINIC ACID, S-BUTYL ESTER
SpectraBase Compound ID KhtGEPFHxPJ
InChI InChI=1S/C8H18OS2/c1-3-5-7-10-11(9)8-6-4-2/h3-8H2,1-2H3
InChIKey XSHPYKKTJQSNFE-UHFFFAOYSA-N
Mol Weight 194.35 g/mol
Molecular Formula C8H18OS2
Exact Mass 194.079908 g/mol

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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 29sSTsjn13I
Name THIO-1-BUTANESULFINIC ACID, S-BUTYL ESTER
Source of Sample F. Freeman, C. N. Angeletakis J. Org. Chem. 47, 4194(1982)
CAS Registry Number 7559-55-9
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18OS2
InChI InChI=1S/C8H18OS2/c1-3-5-7-10-11(9)8-6-4-2/h3-8H2,1-2H3
InChIKey XSHPYKKTJQSNFE-UHFFFAOYSA-N
Molecular Weight 194.36
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-250
Synonyms 1-BUTANESULFINIC ACID, THIO-, S-BUTYL ESTER