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3-PERHYDROAZEPINOPERFLUORO-2-METHYLPENTENE-2
SpectraBase Compound ID FIWMQ9hVjVh
InChI InChI=1S/C12H12F11N/c13-9(14,12(21,22)23)8(24-5-3-1-2-4-6-24)7(10(15,16)17)11(18,19)20/h1-6H2
InChIKey WNKAPLIKMMBOSV-UHFFFAOYSA-N
Mol Weight 379.22 g/mol
Molecular Formula C12H12F11N
Exact Mass 379.079409 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KgWJsPhS3V
Name 3-PERHYDROAZEPINOPERFLUORO-2-METHYLPENTENE-2
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 C12H12F11N
InChI InChI=1S/C12H12F11N/c13-9(14,12(21,22)23)8(24-5-3-1-2-4-6-24)7(10(15,16)17)11(18,19)20/h1-6H2
InChIKey WNKAPLIKMMBOSV-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.F.SNEGIREV, E.V.ZAKHAROVA, K.N.MAKAROV, I.L.KNUNYANTS (1983) Izv.Akad.NaukSSSR(Russ. Lang.): N11, 2561-2568.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported