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N-(3-Chloro-4-fluoro-phenyl)-2-(4-chloro-phenylsulfanyl)-acetamide

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

N-(3-Chloro-4-fluoro-phenyl)-2-(4-chloro-phenylsulfanyl)-acetamide
SpectraBase Compound ID H4Fx75F8Fyd
InChI InChI=1S/C14H10Cl2FNOS/c15-9-1-4-11(5-2-9)20-8-14(19)18-10-3-6-13(17)12(16)7-10/h1-7H,8H2,(H,18,19)
InChIKey IVSONCCKUMTPBT-UHFFFAOYSA-N
Mol Weight 330.2 g/mol
Molecular Formula C14H10Cl2FNOS
Exact Mass 328.984419 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GYRCGK8q0Wt
Name N-(3-Chloro-4-fluoro-phenyl)-2-(4-chloro-phenylsulfanyl)-acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.984418682 u
Formula C14H10Cl2FNOS
InChI InChI=1S/C14H10Cl2FNOS/c15-9-1-4-11(5-2-9)20-8-14(19)18-10-3-6-13(17)12(16)7-10/h1-7H,8H2,(H,18,19)
InChIKey IVSONCCKUMTPBT-UHFFFAOYSA-N
Molecular Weight 330.204 g/mol
SMILES C1(=CC(NC(=O)CSC=2C=CC(=CC2)Cl)=CC=C1F)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.900964