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2-(4-Bromo-phenylamino)-N-phenyl-2-thioxo-acetamide

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

2-(4-Bromo-phenylamino)-N-phenyl-2-thioxo-acetamide
SpectraBase Compound ID 3EX5oF6DlnS
InChI InChI=1S/C14H11BrN2OS/c15-10-6-8-12(9-7-10)17-14(19)13(18)16-11-4-2-1-3-5-11/h1-9H,(H,16,18)(H,17,19)
InChIKey XGZMXXNMWUMIKC-UHFFFAOYSA-N
Mol Weight 335.22 g/mol
Molecular Formula C14H11BrN2OS
Exact Mass 333.977547 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IZagwsb1vf8
Name 2-(4-Bromo-phenylamino)-N-phenyl-2-thioxo-acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.977547155 u
Formula C14H11BrN2OS
InChI InChI=1S/C14H11BrN2OS/c15-10-6-8-12(9-7-10)17-14(19)13(18)16-11-4-2-1-3-5-11/h1-9H,(H,16,18)(H,17,19)
InChIKey XGZMXXNMWUMIKC-UHFFFAOYSA-N
Molecular Weight 335.219 g/mol
SMILES C(NC1=CC=C(C=C1)Br)(=S)C(NC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960193