For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-TRIFLUOROMETHYL-2-PHENYLTHIO-3,3,3-TRIFLUOROPROPANOIC ACID,PENTAFLUOROETHYL ESTER
SpectraBase Compound ID 1TGiMgedchW
InChI InChI=1S/C12H5F11O2S/c13-9(14,15)8(10(16,17)18,26-6-4-2-1-3-5-6)7(24)25-12(22,23)11(19,20)21/h1-5H
InChIKey YMWGSOFRWRJFNM-UHFFFAOYSA-N
Mol Weight 422.21 g/mol
Molecular Formula C12H5F11O2S
Exact Mass 421.98346 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ef8Pyo0Q7y4
Name 2-TRIFLUOROMETHYL-2-PHENYLTHIO-3,3,3-TRIFLUOROPROPANOIC ACID,PENTAFLUOROETHYL ESTER
Comments -3.0, -36.0 WERE REASSIGNED (S.T.). SCALE INVERTED;R-20A (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H5F11O2S
InChI InChI=1S/C12H5F11O2S/c13-9(14,15)8(10(16,17)18,26-6-4-2-1-3-5-6)7(24)25-12(22,23)11(19,20)21/h1-5H
InChIKey YMWGSOFRWRJFNM-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference YU.V.ZEIFMAN, L.T.LANTSEVA (1980) Izv.Akad.Nauk SSSR(Russ. Lang.): N5, 1102-1106.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported