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Tris-(2-chlorobenzyl)amine

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

Tris-(2-chlorobenzyl)amine
SpectraBase Compound ID zWQbrWModz
InChI InChI=1S/C21H18Cl3N/c22-19-10-4-1-7-16(19)13-25(14-17-8-2-5-11-20(17)23)15-18-9-3-6-12-21(18)24/h1-12H,13-15H2
InChIKey UYMODAYUSAHXCW-UHFFFAOYSA-N
Mol Weight 390.74 g/mol
Molecular Formula C21H18Cl3N
Exact Mass 389.050483 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DHstKFBwkP7
Name Tris-(2-chlorobenzyl)amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.050482684 u
Formula C21H18Cl3N
InChI InChI=1S/C21H18Cl3N/c22-19-10-4-1-7-16(19)13-25(14-17-8-2-5-11-20(17)23)15-18-9-3-6-12-21(18)24/h1-12H,13-15H2
InChIKey UYMODAYUSAHXCW-UHFFFAOYSA-N
Molecular Weight 390.741 g/mol
SMILES C(N(CC=1C(=CC=CC1)Cl)CC1=C(C=CC=C1)Cl)C1=C(C=CC=C1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847306