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ETHYL ALPHA-(3,3,4,4,5,5,6,6,6-NONAFLUOROHEXYLTHIO)-ALPHA-(3,3,4,4,5,5,6,6,7,7,8,8,8-TRIDECAFLUOROOCT-1-YLTHIO)ACETATE
SpectraBase Compound ID 8TAuZCCnjfq
InChI InChI=1S/C18H14F22O2S2/c1-2-42-7(41)8(44-6-4-10(21,22)12(25,26)15(31,32)17(35,36)37)43-5-3-9(19,20)11(23,24)13(27,28)14(29,30)16(33,34)18(38,39)40/h8H,2-6H2,1H3
InChIKey BPVXONCLGHSJEN-UHFFFAOYSA-N
Mol Weight 744.39 g/mol
Molecular Formula C18H14F22O2S2
Exact Mass 744.008392 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5RaV0br26He
Name ETHYL ALPHA-(3,3,4,4,5,5,6,6,6-NONAFLUOROHEXYLTHIO)-ALPHA-(3,3,4,4,5,5,6,6,7,7,8,8,8-TRIDECAFLUOROOCT-1-YLTHIO)ACETATE
Comments -122.5:-125.1-RANGE. NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H14F22O2S2
InChI InChI=1S/C18H14F22O2S2/c1-2-42-7(41)8(44-6-4-10(21,22)12(25,26)15(31,32)17(35,36)37)43-5-3-9(19,20)11(23,24)13(27,28)14(29,30)16(33,34)18(38,39)40/h8H,2-6H2,1H3
InChIKey BPVXONCLGHSJEN-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference S.Y.DIENG, L.ROMAN, F.SZONYI, A.CAMBON (1991) J.Fluor.Chem.: v.51, N2, 155-164.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d