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N-(3,5-Dimethoxyphenyl)-2,2,2-trifluoroacetamide

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N-(3,5-Dimethoxyphenyl)-2,2,2-trifluoroacetamide
SpectraBase Compound ID 2U5cMKrY2aX
InChI InChI=1S/C10H10F3NO3/c1-16-7-3-6(4-8(5-7)17-2)14-9(15)10(11,12)13/h3-5H,1-2H3,(H,14,15)
InChIKey JBVIFDIYLLRZDA-UHFFFAOYSA-N
Mol Weight 249.19 g/mol
Molecular Formula C10H10F3NO3
Exact Mass 249.061278 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JNG2KP4064N
Name N-(3,5-Dimethoxyphenyl)-2,2,2-trifluoroacetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.061277672 u
Formula C10H10F3NO3
InChI InChI=1S/C10H10F3NO3/c1-16-7-3-6(4-8(5-7)17-2)14-9(15)10(11,12)13/h3-5H,1-2H3,(H,14,15)
InChIKey JBVIFDIYLLRZDA-UHFFFAOYSA-N
Molecular Weight 249.189 g/mol
SMILES C(F)(F)(F)C(=O)NC1=CC(=CC(=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867102