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PERFLUORO-2-METHYL-2-PENTENTHIOL-3, TRIETHYLAMMONIUM ENTHIOLATE
SpectraBase Compound ID J6ttjnMWveA
InChI InChI=1S/C6HF11S.C6H15N/c7-3(8,6(15,16)17)2(18)1(4(9,10)11)5(12,13)14;1-4-7(5-2)6-3/h18H;4-6H2,1-3H3
InChIKey DDFFCHRNVBFCKK-UHFFFAOYSA-N
Mol Weight 415.31 g/mol
Molecular Formula C12H16F11NS
Exact Mass 415.08278 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iNfkppR7tO
Name PERFLUORO-2-METHYL-2-PENTENTHIOL-3, TRIETHYLAMMONIUM ENTHIOLATE
Comments CIS AND TRANS CF3 ARE ASSIGNED EXACTLY. SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16F11NS
InChI InChI=1S/C6HF11S.C6H15N/c7-3(8,6(15,16)17)2(18)1(4(9,10)11)5(12,13)14;1-4-7(5-2)6-3/h18H;4-6H2,1-3H3
InChIKey DDFFCHRNVBFCKK-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference R.A.BEKKER, V.YA.POPKOVA, I.L.KNUNYANTS (1982) Izv.Akad.Nauk SSSR(Russ. Lang.):N10, 2347-2354.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported