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4-Iodobenzotrifluoride

View entire compound with spectra: 4 NMR, 6 FTIR, 1 Raman, 1 UV-Vis, and 1 MS (GC)

4-Iodobenzotrifluoride
SpectraBase Compound ID JuVy0lQLRZm
InChI InChI=1S/C7H4F3I/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H
InChIKey SKGRFPGOGCHDPC-UHFFFAOYSA-N
Mol Weight 272.01 g/mol
Molecular Formula C7H4F3I
Exact Mass 271.93098 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5EnrQszEanh
Name 4-Iodobenzotrifluoride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 365858
CAS Registry Number 455-13-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4F3I
InChI InChI=1S/C7H4F3I/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H
InChIKey SKGRFPGOGCHDPC-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-Iodo-alpha,alpha,alpha-trifluorotoluene
Wiley ID SIAL_13CNMR_007726