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2,2,2-Trifluoro-N-(1-(4-methoxy-3-methylphenyl)butan-2-yl)acetamide

View entire compound with spectra: 1 FTIR

2,2,2-Trifluoro-N-(1-(4-methoxy-3-methylphenyl)butan-2-yl)acetamide
SpectraBase Compound ID 9U9T8Hi12E2
InChI InChI=1S/C14H18F3NO2/c1-4-11(18-13(19)14(15,16)17)8-10-5-6-12(20-3)9(2)7-10/h5-7,11H,4,8H2,1-3H3,(H,18,19)
InChIKey ZWJOYIHBKVVJIQ-UHFFFAOYSA-N
Mol Weight 289.3 g/mol
Molecular Formula C14H18F3NO2
Exact Mass 289.128963 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3QRdTsGOJnz
Name 2,2,2-Trifluoro-N-(1-(4-methoxy-3-methylphenyl)butan-2-yl)acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.128963311 u
Formula C14H18F3NO2
InChI InChI=1S/C14H18F3NO2/c1-4-11(18-13(19)14(15,16)17)8-10-5-6-12(20-3)9(2)7-10/h5-7,11H,4,8H2,1-3H3,(H,18,19)
InChIKey ZWJOYIHBKVVJIQ-UHFFFAOYSA-N
Molecular Weight 289.298 g/mol
SMILES C1=C(C(=CC(=C1)CC(NC(C(F)(F)F)=O)CC)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.893287