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5-Chloro-2-(4-chlorophenoxy)aniline

View entire compound with spectra: 1 NMR, and 1 FTIR

5-Chloro-2-(4-chlorophenoxy)aniline
SpectraBase Compound ID 45ELi1EPkrA
InChI InChI=1S/C12H9Cl2NO/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7H,15H2
InChIKey WLJSUJOESWTGEX-UHFFFAOYSA-N
Mol Weight 254.12 g/mol
Molecular Formula C12H9Cl2NO
Exact Mass 253.006119 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GIEGuE7oSL3
Name 5-Chloro-2-(4-chlorophenoxy)aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.006119313 u
Formula C12H9Cl2NO
InChI InChI=1S/C12H9Cl2NO/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7H,15H2
InChIKey WLJSUJOESWTGEX-UHFFFAOYSA-N
Molecular Weight 254.116 g/mol
SMILES C1(Cl)=CC(=C(C=C1)OC1=CC=C(C=C1)Cl)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938389