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1-MERCAPTO-2,4,5-TRIFLUOROBENZENE-3,6-DISULPHONATE
SpectraBase Compound ID FFnsOpx9MeT
InChI InChI=1S/C6H3F3O6S3/c7-1-2(8)6(18(13,14)15)4(16)3(9)5(1)17(10,11)12/h16H,(H,10,11,12)(H,13,14,15)
InChIKey DXLRHIJAHBNQRE-UHFFFAOYSA-N
Mol Weight 324.26 g/mol
Molecular Formula C6H3F3O6S3
Exact Mass 323.904386 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 32Dx77uJi0r
Name 1-MERCAPTO-2,4,5-TRIFLUOROBENZENE-3,6-DISULPHONATE
Comments C=0.5M
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H3F3O6S3
InChI InChI=1S/C6H3F3O6S3/c7-1-2(8)6(18(13,14)15)4(16)3(9)5(1)17(10,11)12/h16H,(H,10,11,12)(H,13,14,15)
InChIKey DXLRHIJAHBNQRE-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference P.SARTORI, G.BAUER (1979) J.Fluor.Chem.: v.14, N3, 201-221.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O deuterium oxide