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Benzamide, N-(2-iodo-4-methylphenyl)-4-trifluoromethyl-

View entire compound with spectra: 1 FTIR

Benzamide, N-(2-iodo-4-methylphenyl)-4-trifluoromethyl-
SpectraBase Compound ID 8PnX0UEi7nm
InChI InChI=1S/C15H11F3INO/c1-9-2-7-13(12(19)8-9)20-14(21)10-3-5-11(6-4-10)15(16,17)18/h2-8H,1H3,(H,20,21)
InChIKey ACSUXEIDGLEBND-UHFFFAOYSA-N
Mol Weight 405.16 g/mol
Molecular Formula C15H11F3INO
Exact Mass 404.983743 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HiJjMD2gTGG
Name Benzamide, N-(2-iodo-4-methylphenyl)-4-trifluoromethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.983743466 u
Formula C15H11F3INO
InChI InChI=1S/C15H11F3INO/c1-9-2-7-13(12(19)8-9)20-14(21)10-3-5-11(6-4-10)15(16,17)18/h2-8H,1H3,(H,20,21)
InChIKey ACSUXEIDGLEBND-UHFFFAOYSA-N
Molecular Weight 405.159 g/mol
SMILES C1=C(C=CC(=C1)C(NC1=C(C=C(C)C=C1)I)=O)C(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.872741