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3-(2-ACETOXY-1,1,1,3,3-PENTAFLUORO-2-PROPYL)-5,5-BIS(TRIFLUOROMETHYL)-1,4,2-DIOXAZOLINE
SpectraBase Compound ID DLD0sQVHm5j
InChI InChI=1S/C9H4F11NO4/c1-2(22)23-6(13,14)3(5(10,11)12)4-21-25-7(24-4,8(15,16)17)9(18,19)20/h3H,1H3
InChIKey QNJUAMHWCKYSOH-UHFFFAOYSA-N
Mol Weight 399.12 g/mol
Molecular Formula C9H4F11NO4
Exact Mass 398.996467 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H59fwvE7vTF
Name 3-(2-ACETOXY-1,1,1,3,3-PENTAFLUORO-2-PROPYL)-5,5-BIS(TRIFLUOROMETHYL)-1,4,2-DIOXAZOLINE
Comments SCALE INVERTED;R-20A (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H4F11NO4
InChI InChI=1S/C9H4F11NO4/c1-2(22)23-6(13,14)3(5(10,11)12)4-21-25-7(24-4,8(15,16)17)9(18,19)20/h3H,1H3
InChIKey QNJUAMHWCKYSOH-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference N.V.VASIL'EV, S.A.KHOKHLOVA, A.F.KOLOMIETS, G.A.SOKOL'SKY (1984)Zhurn.Org.Khim.(Russ. Lang.): v.20, N9, 1983-1991.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3 chloroform