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2',4'-DIFLUORO-ALPHA-(METHYLTHIO)-ACETOPHENONE
SpectraBase Compound ID CKET2D962vt
InChI InChI=1S/C9H8F2OS/c1-13-5-9(12)7-3-2-6(10)4-8(7)11/h2-4H,5H2,1H3
InChIKey BNIWUBRPXPZHFK-UHFFFAOYSA-N
Mol Weight 202.22 g/mol
Molecular Formula C9H8F2OS
Exact Mass 202.026392 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7KZgkw78w0
Name 2',4'-DIFLUORO-ALPHA-(METHYLTHIO)-ACETOPHENONE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8F2OS
InChI InChI=1S/C9H8F2OS/c1-13-5-9(12)7-3-2-6(10)4-8(7)11/h2-4H,5H2,1H3
InChIKey BNIWUBRPXPZHFK-UHFFFAOYSA-N
Literature Reference Author S.TAKEDA,Y.KANEKO,H.ETO,M.TOKIZAWA,S.SATO,K.YOSHIDA,S.NAMIKI ,M.OGAWA
Literature Reference Citation CHEM.PHARM.BULL.,48,1097(2000)
Literature Reference DOI 10.1248/cpb.48.1097
Molecular Weight 202.219 g/mol
Solvent CDCl3
Source File Reference UWVN4421