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3-(Trifluoromethyl)anisole

View entire compound with spectra: 5 NMR, 5 FTIR, 2 Raman, and 1 MS (GC)

3-(Trifluoromethyl)anisole
SpectraBase Compound ID 4Jsh05jHeYI
InChI InChI=1S/C8H7F3O/c1-12-7-4-2-3-6(5-7)8(9,10)11/h2-5H,1H3
InChIKey XHONYVFDZSPELQ-UHFFFAOYSA-N
Mol Weight 176.14 g/mol
Molecular Formula C8H7F3O
Exact Mass 176.044899 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAfv1Iy6ZR5
Name M-(TRIFLUOROMETHYL)-ANISOLE
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7F3O
InChI InChI=1S/C8H7F3O/c1-12-7-4-2-3-6(5-7)8(9,10)11/h2-5H,1H3
InChIKey XHONYVFDZSPELQ-UHFFFAOYSA-N
Literature Reference Author Y.KOBAYASHI,I.KUMADAKI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,661(1980)
Literature Reference DOI 10.1039/p19800000661
Solvent Unknown
Source File Reference UWPS3034