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ETHYL-2-(TRIFLUOROMETHYLTHIO)-ACETATE

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ETHYL-2-(TRIFLUOROMETHYLTHIO)-ACETATE
SpectraBase Compound ID 8WNwXXqOE04
InChI InChI=1S/C5H7F3O2S/c1-2-10-4(9)3-11-5(6,7)8/h2-3H2,1H3
InChIKey OFWYGBPXVQQCGS-UHFFFAOYSA-N
Mol Weight 188.16 g/mol
Molecular Formula C5H7F3O2S
Exact Mass 188.011885 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B9laaJBW1ev
Name ETHYL-2-(TRIFLUOROMETHYLTHIO)-ACETATE
Compound Number 5H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H7F3O2S
InChI InChI=1S/C5H7F3O2S/c1-2-10-4(9)3-11-5(6,7)8/h2-3H2,1H3
InChIKey OFWYGBPXVQQCGS-UHFFFAOYSA-N
Literature Reference Author T.BILLARD,N.ROQUES,B.R.LANGLOIS
Literature Reference Citation J.ORG.CHEM.,64,3813(1999)
Literature Reference DOI 10.1021/jo980649a
Molecular Weight 188.165 g/mol
Sample ID 59404
Solvent CDCl3