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4-keto-2-(1,1,2,2,2-pentafluoroethyl)pentanethioic acid S-ethyl ester

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4-keto-2-(1,1,2,2,2-pentafluoroethyl)pentanethioic acid S-ethyl ester
SpectraBase Compound ID K0QN1qPuYFn
InChI InChI=1S/C9H11F5O2S/c1-3-17-7(16)6(4-5(2)15)8(10,11)9(12,13)14/h6H,3-4H2,1-2H3
InChIKey REDALWVGKLXNPX-UHFFFAOYSA-N
Mol Weight 278.24 g/mol
Molecular Formula C9H11F5O2S
Exact Mass 278.039992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AkiuOaGa9p9
Name 4-keto-2-(1,1,2,2,2-pentafluoroethyl)pentanethioic acid S-ethyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11F5O2S
InChI InChI=1S/C9H11F5O2S/c1-3-17-7(16)6(4-5(2)15)8(10,11)9(12,13)14/h6H,3-4H2,1-2H3
InChIKey REDALWVGKLXNPX-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 278.237 g/mol
Source File Reference MHKO26785