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3-Fluoro-6-trifluoromethylbenzamide, N-(2,5-dimethoxyphenyl)-
SpectraBase Compound ID 2uSZ5QPgWZL
InChI InChI=1S/C16H13F4NO3/c1-23-10-4-6-14(24-2)13(8-10)21-15(22)11-7-9(17)3-5-12(11)16(18,19)20/h3-8H,1-2H3,(H,21,22)
InChIKey NFLZGGYUUHKNPO-UHFFFAOYSA-N
Mol Weight 343.28 g/mol
Molecular Formula C16H13F4NO3
Exact Mass 343.083156 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 73XXaN92hqZ
Name 3-Fluoro-6-trifluoromethylbenzamide, N-(2,5-dimethoxyphenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.083155932 u
Formula C16H13F4NO3
InChI InChI=1S/C16H13F4NO3/c1-23-10-4-6-14(24-2)13(8-10)21-15(22)11-7-9(17)3-5-12(11)16(18,19)20/h3-8H,1-2H3,(H,21,22)
InChIKey NFLZGGYUUHKNPO-UHFFFAOYSA-N
Molecular Weight 343.278 g/mol
SMILES COC1=CC=C(OC)C(=C1)NC(C1=C(C(F)(F)F)C=CC(=C1)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.830051