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Benzamide, N-(2-iodo-4-methylphenyl)-3-methyl-
SpectraBase Compound ID 7XPz6PRUND3
InChI InChI=1S/C15H14INO/c1-10-4-3-5-12(8-10)15(18)17-14-7-6-11(2)9-13(14)16/h3-9H,1-2H3,(H,17,18)
InChIKey LRRRGSNFNASUFB-UHFFFAOYSA-N
Mol Weight 351.19 g/mol
Molecular Formula C15H14INO
Exact Mass 351.012009 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BNz1b1ue74E
Name Benzamide, N-(2-iodo-4-methylphenyl)-3-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.012009074 u
Formula C15H14INO
InChI InChI=1S/C15H14INO/c1-10-4-3-5-12(8-10)15(18)17-14-7-6-11(2)9-13(14)16/h3-9H,1-2H3,(H,17,18)
InChIKey LRRRGSNFNASUFB-UHFFFAOYSA-N
Molecular Weight 351.187 g/mol
SMILES C1=CC=C(C=C1C)C(NC=1C=CC(C)=CC1I)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921802