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4-(Trifluoromethoxy)-2-(trifluoromethyl)aniline

View entire compound with spectra: 1 FTIR

4-(Trifluoromethoxy)-2-(trifluoromethyl)aniline
SpectraBase Compound ID 35pDIcTivMO
InChI InChI=1S/C8H5F6NO/c9-7(10,11)5-3-4(1-2-6(5)15)16-8(12,13)14/h1-3H,15H2
InChIKey FYZGPCRHKPVHOY-UHFFFAOYSA-N
Mol Weight 245.12 g/mol
Molecular Formula C8H5F6NO
Exact Mass 245.027533 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JIyyDky8EUB
Name 4-(Trifluoromethoxy)-2-(trifluoromethyl)aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 245.027532762 u
Formula C8H5F6NO
InChI InChI=1S/C8H5F6NO/c9-7(10,11)5-3-4(1-2-6(5)15)16-8(12,13)14/h1-3H,15H2
InChIKey FYZGPCRHKPVHOY-UHFFFAOYSA-N
Molecular Weight 245.124 g/mol
SMILES C(F)(F)(F)OC1=CC(=C(C=C1)N)C(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941751