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N-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-phenyl-ethyl]acetamide
SpectraBase Compound ID WQ0WydH8g
InChI InChI=1S/C16H13F4NO/c1-11(22)21-15(16(18,19)20,12-5-3-2-4-6-12)13-7-9-14(17)10-8-13/h2-10H,1H3,(H,21,22)
InChIKey CWOLQYXNVIQNAK-UHFFFAOYSA-N
Mol Weight 311.28 g/mol
Molecular Formula C16H13F4NO
Exact Mass 311.093327 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JpWxrQHSpBg
Name N-[2,2,2-Trifluoro-1-(4-fluorophenyl)-1-phenyl-ethyl]acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.093326694 u
Formula C16H13F4NO
InChI InChI=1S/C16H13F4NO/c1-11(22)21-15(16(18,19)20,12-5-3-2-4-6-12)13-7-9-14(17)10-8-13/h2-10H,1H3,(H,21,22)
InChIKey CWOLQYXNVIQNAK-UHFFFAOYSA-N
Molecular Weight 311.280 g/mol
SMILES C(C(F)(F)F)(NC(=O)C)(C=1C=CC(=CC1)F)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.850765