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2-(PERFLUORO-2-METHYL-3-OXAHEXANOYL)AMINOBENZENETHIOL
SpectraBase Compound ID 4oyQlsfne8h
InChI InChI=1S/C12H6F11NO2S/c13-8(10(16,17)18,7(25)24-5-3-1-2-4-6(5)27)26-12(22,23)9(14,15)11(19,20)21/h1-4,27H,(H,24,25)
InChIKey HNPAWFCMCLCJQE-UHFFFAOYSA-N
Mol Weight 437.23 g/mol
Molecular Formula C12H6F11NO2S
Exact Mass 436.994359 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DN53wURqvzU
Name 2-(PERFLUORO-2-METHYL-3-OXAHEXANOYL)AMINOBENZENETHIOL
Comments SCALE INVERTED
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Formula C12H6F11NO2S
InChI InChI=1S/C12H6F11NO2S/c13-8(10(16,17)18,7(25)24-5-3-1-2-4-6(5)27)26-12(22,23)9(14,15)11(19,20)21/h1-4,27H,(H,24,25)
InChIKey HNPAWFCMCLCJQE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference K.C.EAPEN, C.TAMBORSKI (1978) J.Fluor.Chem.: v.12, N4, 271-280.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported