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N-(4-Bromo-2,6-dimethyl-phenyl)-2,2-diphenyl-acetamide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

N-(4-Bromo-2,6-dimethyl-phenyl)-2,2-diphenyl-acetamide
SpectraBase Compound ID 5jRxCosnpjs
InChI InChI=1S/C22H20BrNO/c1-15-13-19(23)14-16(2)21(15)24-22(25)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-14,20H,1-2H3,(H,24,25)
InChIKey VPCGKQLMZQFSTN-UHFFFAOYSA-N
Mol Weight 394.31 g/mol
Molecular Formula C22H20BrNO
Exact Mass 393.072827 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7HXobTvX1By
Name N-(4-Bromo-2,6-dimethyl-phenyl)-2,2-diphenyl-acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.072827267 u
Formula C22H20BrNO
InChI InChI=1S/C22H20BrNO/c1-15-13-19(23)14-16(2)21(15)24-22(25)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-14,20H,1-2H3,(H,24,25)
InChIKey VPCGKQLMZQFSTN-UHFFFAOYSA-N
Molecular Weight 394.312 g/mol
SMILES C(NC1=C(C=C(C=C1C)Br)C)(C(C=1C=CC=CC1)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91538