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o-IODO-alpha,alpha,alpha-TRIFLUOROTOLUENE
SpectraBase Compound ID JTCZdvrxDDb
InChI InChI=1S/C7H4F3I/c8-7(9,10)5-3-1-2-4-6(5)11/h1-4H
InChIKey IGZGUYVVBABKOY-UHFFFAOYSA-N
Mol Weight 272.01 g/mol
Molecular Formula C7H4F3I
Exact Mass 271.93098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5MfrdglaCmG
Name 2-Iodo-trifluoromethyl-benzene
CAS Registry Number 444-29-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H4F3I
InChI InChI=1S/C7H4F3I/c8-7(9,10)5-3-1-2-4-6(5)11/h1-4H
InChIKey IGZGUYVVBABKOY-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference R.A. Newmark, J.R. Hill, Org. Magn. Resonance 9, 589 (1977).
NMR Standard Benzene-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid