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N-(2,2,2-Trifluoro-1-phenylethylidene)-3,5-bis(trifluoromethyl)aniline

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

N-(2,2,2-Trifluoro-1-phenylethylidene)-3,5-bis(trifluoromethyl)aniline
SpectraBase Compound ID JC59aaZGuRt
InChI InChI=1S/C16H8F9N/c17-14(18,19)10-6-11(15(20,21)22)8-12(7-10)26-13(16(23,24)25)9-4-2-1-3-5-9/h1-8H/b26-13+
InChIKey VIFGGAGCZPWWQV-LGJNPRDNSA-N
Mol Weight 385.23 g/mol
Molecular Formula C16H8F9N
Exact Mass 385.051303 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BZrx5GvVbnj
Name N-(2,2,2-Trifluoro-1-phenylethylidene)-3,5-bis(trifluoromethyl)aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.051302729 u
Formula C16H8F9N
InChI InChI=1S/C16H8F9N/c17-14(18,19)10-6-11(15(20,21)22)8-12(7-10)26-13(16(23,24)25)9-4-2-1-3-5-9/h1-8H/b26-13+
InChIKey VIFGGAGCZPWWQV-LGJNPRDNSA-N
Molecular Weight 385.233 g/mol
SMILES C(\C(=N\C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)C=1C=CC=CC1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.852227