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N-Methyl-N-3-trifluoromethylbenzyl-4chloroaniline

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

N-Methyl-N-3-trifluoromethylbenzyl-4chloroaniline
SpectraBase Compound ID BQl42cb5NHx
InChI InChI=1S/C15H13ClF3N/c1-20(14-7-5-13(16)6-8-14)10-11-3-2-4-12(9-11)15(17,18)19/h2-9H,10H2,1H3
InChIKey FPNYWFZMUQCLQD-UHFFFAOYSA-N
Mol Weight 299.72 g/mol
Molecular Formula C15H13ClF3N
Exact Mass 299.068862 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KbPOz4JGL1H
Name N-Methyl-N-3-trifluoromethylbenzyl-4chloroaniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.068861612 u
Formula C15H13ClF3N
InChI InChI=1S/C15H13ClF3N/c1-20(14-7-5-13(16)6-8-14)10-11-3-2-4-12(9-11)15(17,18)19/h2-9H,10H2,1H3
InChIKey FPNYWFZMUQCLQD-UHFFFAOYSA-N
Molecular Weight 299.724 g/mol
SMILES C(C1=CC(CN(C=2C=CC(=CC2)Cl)C)=CC=C1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917978