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ETHYL-2,2-DIFLUORO-2-[(4-METHOXYBENZYL)-THIO]-ACETATE
SpectraBase Compound ID HyfnlutZzfr
InChI InChI=1S/C12H14F2O3S/c1-3-17-11(15)12(13,14)18-8-9-4-6-10(16-2)7-5-9/h4-7H,3,8H2,1-2H3
InChIKey PABJEJBLLAFEGY-UHFFFAOYSA-N
Mol Weight 276.3 g/mol
Molecular Formula C12H14F2O3S
Exact Mass 276.063172 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Xf0pNhwMfb
Name ETHYL-2,2-DIFLUORO-2-[(4-METHOXYBENZYL)-THIO]-ACETATE
Compound Number 6Q
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14F2O3S
InChI InChI=1S/C12H14F2O3S/c1-3-17-11(15)12(13,14)18-8-9-4-6-10(16-2)7-5-9/h4-7H,3,8H2,1-2H3
InChIKey PABJEJBLLAFEGY-UHFFFAOYSA-N
Literature Reference Author H.ETO,Y.KANEKO,S.TAKEDA,M.TOKIZAWA,S.SATO,K.YOSHIDA,S.NAMIKI ,M.OGAWA,K.MAEBASHI,
Literature Reference Citation CHEM.PHARM.BULL.,49,173(2001)
Literature Reference DOI 10.1248/cpb.49.173
Solvent CDCl3
Source File Reference UWVN29025