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2-Chloro-5-(trifluoromethyl)phenol

View entire compound with spectra: 4 NMR, 5 FTIR, and 1 Raman

2-Chloro-5-(trifluoromethyl)phenol
SpectraBase Compound ID L2ke6AYoYJn
InChI InChI=1S/C7H4ClF3O/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3,12H
InChIKey SUIZARUATMVYRT-UHFFFAOYSA-N
Mol Weight 196.56 g/mol
Molecular Formula C7H4ClF3O
Exact Mass 195.990277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5FkL0A59vBJ
Name 2-Chloro-5-trifluoromethyl-phenol
CAS Registry Number 40889-91-6
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C7H4ClF3O
InChI InChI=1S/C7H4ClF3O/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3,12H
InChIKey SUIZARUATMVYRT-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