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2-(PERFLUOROHEXYLTHIO)BENZOTHIAZOLE
SpectraBase Compound ID 2NKccRY4P1M
InChI InChI=1S/C13H4F13NS2/c14-8(15,10(18,19)12(22,23)24)9(16,17)11(20,21)13(25,26)29-7-27-5-3-1-2-4-6(5)28-7/h1-4H
InChIKey NSPWZNNVNOVUFA-UHFFFAOYSA-N
Mol Weight 485.28 g/mol
Molecular Formula C13H4F13NS2
Exact Mass 484.957758 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDtDyQZnl8U
Name 2-(PERFLUOROHEXYLTHIO)BENZOTHIAZOLE
Comments SCALE INVERTED.
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Formula C13H4F13NS2
InChI InChI=1S/C13H4F13NS2/c14-8(15,10(18,19)12(22,23)24)9(16,17)11(20,21)13(25,26)29-7-27-5-3-1-2-4-6(5)28-7/h1-4H
InChIKey NSPWZNNVNOVUFA-UHFFFAOYSA-N
Instrument Name Varian EM-360
Literature Reference QING-YUN CHEN, MEI-JIN CHEN (1991) J.Fluor.Chem.: v.51, N1, 21-32.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported