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2,2-DIMETHYL-4,4-BIS(TRIFLUOROMETHYL)-6-(2-HYDROHEXAFLUORO-2-PROPYL)-1,3,2,5-DIOXATHIAZINE
SpectraBase Compound ID H2JGd5tfZNT
InChI InChI=1S/C9H7F12NO2S/c1-25(2)23-4(3(5(10,11)12)6(13,14)15)22-7(24-25,8(16,17)18)9(19,20)21/h3H,1-2H3
InChIKey BPUJSGXGNPUBKC-UHFFFAOYSA-N
Mol Weight 421.2 g/mol
Molecular Formula C9H7F12NO2S
Exact Mass 421.000588 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4m6chGWGqro
Name 2,2-DIMETHYL-4,4-BIS(TRIFLUOROMETHYL)-6-(2-HYDROHEXAFLUORO-2-PROPYL)-1,3,2,5-DIOXATHIAZINE
Comments SCALE INVERTED;R-20A (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7F12NO2S
InChI InChI=1S/C9H7F12NO2S/c1-25(2)23-4(3(5(10,11)12)6(13,14)15)22-7(24-25,8(16,17)18)9(19,20)21/h3H,1-2H3
InChIKey BPUJSGXGNPUBKC-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference L.N.KRYUKOV, L.YU.KRYUKOVA, A.F.KOLOMIETS, G.A.SOKOL'SKY (1980)Zhurn.Org.Khim.(Russ. Lang.): v.16, N2, 463-464.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported