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TOLUENE, M-IODO-A,A,A-TRIFLUORO-,

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TOLUENE, M-IODO-A,A,A-TRIFLUORO-,
SpectraBase Compound ID 9REHoPnLmcm
InChI InChI=1S/C7H4F3I/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4H
InChIKey IGISPMBUGPHLBY-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 5fwuPq5ahMe
Name 3-Iodo-trifluoromethyl-benzene
CAS Registry Number 401-81-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H4F3I
InChI InChI=1S/C7H4F3I/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4H
InChIKey IGISPMBUGPHLBY-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