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Pentafluorobenzoic acid
SpectraBase Compound ID 8bAA6M0Qj8L
InChI InChI=1S/C7HF5O2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)
InChIKey YZERDTREOUSUHF-UHFFFAOYSA-N
Mol Weight 212.08 g/mol
Molecular Formula C7HF5O2
Exact Mass 211.98967 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1I3iPaBJYNv
Name PENTAFLUOROBENZOIC ACID
Comments C=5%. SCALE INVERTED;JNM-3 (JEOL)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7HF5O2
InChI InChI=1S/C7HF5O2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)
InChIKey YZERDTREOUSUHF-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference L.N.PUSHKINA, A.P.STEPANOV, V.S.ZHUKOV, A.D.NAUMOV (1972) Zhurn.Org.Khim.(Russ.Lang.): v.8, N3, 586-597.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2H6O ethanol