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1,1,1-TRIFLUORO-2-(4-METHYLBENZENESULFONYL)-ETHANE

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1,1,1-TRIFLUORO-2-(4-METHYLBENZENESULFONYL)-ETHANE
SpectraBase Compound ID JrUl7NbxXSi
InChI InChI=1S/C9H9F3O2S/c1-7-2-4-8(5-3-7)15(13,14)6-9(10,11)12/h2-5H,6H2,1H3
InChIKey XLBYTVJETXRZPY-UHFFFAOYSA-N
Mol Weight 238.22 g/mol
Molecular Formula C9H9F3O2S
Exact Mass 238.027535 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C5AyhMXANvF
Name 1,1,1-TRIFLUORO-2-(4-METHYLBENZENESULFONYL)-ETHANE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9F3O2S
InChI InChI=1S/C9H9F3O2S/c1-7-2-4-8(5-3-7)15(13,14)6-9(10,11)12/h2-5H,6H2,1H3
InChIKey XLBYTVJETXRZPY-UHFFFAOYSA-N
Literature Reference Author M.KATO,K.MAEDA,K.SATO,M.OMOTE,A.ANDO,I.KUMADAKI
Literature Reference Citation CHEM.PHARM.BULL.,48,683(2000)
Literature Reference DOI 10.1248/cpb.48.683
Solvent CDCl3
Source File Reference UWLU5129