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Propanamide, N-(2-iodo-4-methylphenyl)-2,2-dimethyl-
SpectraBase Compound ID 2g9uO0oLLWe
InChI InChI=1S/C12H16INO/c1-8-5-6-10(9(13)7-8)14-11(15)12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChIKey BGEQNDMAJXNQSN-UHFFFAOYSA-N
Mol Weight 317.17 g/mol
Molecular Formula C12H16INO
Exact Mass 317.027659 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GeZIsG4PPnI
Name Propanamide, N-(2-iodo-4-methylphenyl)-2,2-dimethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.027659138 u
Formula C12H16INO
InChI InChI=1S/C12H16INO/c1-8-5-6-10(9(13)7-8)14-11(15)12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChIKey BGEQNDMAJXNQSN-UHFFFAOYSA-N
Molecular Weight 317.170 g/mol
SMILES C(C(=O)NC=1C=CC(=CC1I)C)(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955062