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3,5-BIS(TRIFLUOROMETHYLSULPHONYL)PHENYLBUTYLSULPHIDE
SpectraBase Compound ID 4bbq1S3snGr
InChI InChI=1S/C12H12F6O4S3/c1-2-3-4-23-8-5-9(24(19,20)11(13,14)15)7-10(6-8)25(21,22)12(16,17)18/h5-7H,2-4H2,1H3
InChIKey XNAJGYRYAYMOIQ-UHFFFAOYSA-N
Mol Weight 430.39 g/mol
Molecular Formula C12H12F6O4S3
Exact Mass 429.980191 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BlCVFYTV8TQ
Name 3,5-BIS(TRIFLUOROMETHYLSULPHONYL)PHENYLBUTYLSULPHIDE
Comments SCALE INVERTED
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Formula C12H12F6O4S3
InChI InChI=1S/C12H12F6O4S3/c1-2-3-4-23-8-5-9(24(19,20)11(13,14)15)7-10(6-8)25(21,22)12(16,17)18/h5-7H,2-4H2,1H3
InChIKey XNAJGYRYAYMOIQ-UHFFFAOYSA-N
Instrument Name Tesla BS487
Literature Reference V.N.BOIKO, I.V.IGNAT'EV, G.M.SHCHUPAK, L.M.YAGUPOL'SKY (1979)Zhurn.Org.Khim.(Russ. Lang.): v.15, N4, 806-816.
NMR Standard C6H5CF3
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C4H8O tetrahydrofura