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Benzamide, N-(2-iodo-4-methylphenyl)-4-bromo-
SpectraBase Compound ID BPxDKZ8b66s
InChI InChI=1S/C14H11BrINO/c1-9-2-7-13(12(16)8-9)17-14(18)10-3-5-11(15)6-4-10/h2-8H,1H3,(H,17,18)
InChIKey RZGLSSFPVIFGKD-UHFFFAOYSA-N
Mol Weight 416.06 g/mol
Molecular Formula C14H11BrINO
Exact Mass 414.906872 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Jq3J3bxmpu9
Name Benzamide, N-(2-iodo-4-methylphenyl)-4-bromo-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.906871977 u
Formula C14H11BrINO
InChI InChI=1S/C14H11BrINO/c1-9-2-7-13(12(16)8-9)17-14(18)10-3-5-11(15)6-4-10/h2-8H,1H3,(H,17,18)
InChIKey RZGLSSFPVIFGKD-UHFFFAOYSA-N
Molecular Weight 416.056 g/mol
SMILES C1=C(C=CC(=C1)C(NC1=C(C=C(C)C=C1)I)=O)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.878696