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1-(3-Trifluoromethylbenzyl)-4-(4-methylphenyl)piperazine

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

1-(3-Trifluoromethylbenzyl)-4-(4-methylphenyl)piperazine
SpectraBase Compound ID 6q5Y9rna1Xb
InChI InChI=1S/C19H21F3N2/c1-15-5-7-18(8-6-15)24-11-9-23(10-12-24)14-16-3-2-4-17(13-16)19(20,21)22/h2-8,13H,9-12,14H2,1H3
InChIKey VPGAMTLHUMALFM-UHFFFAOYSA-N
Mol Weight 334.39 g/mol
Molecular Formula C19H21F3N2
Exact Mass 334.165683 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5KbakrXeVFc
Name 1-(3-Trifluoromethylbenzyl)-4-(4-methylphenyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.165683173 u
Formula C19H21F3N2
InChI InChI=1S/C19H21F3N2/c1-15-5-7-18(8-6-15)24-11-9-23(10-12-24)14-16-3-2-4-17(13-16)19(20,21)22/h2-8,13H,9-12,14H2,1H3
InChIKey VPGAMTLHUMALFM-UHFFFAOYSA-N
Molecular Weight 334.386 g/mol
SMILES C(C1=CC(CN2CCN(C=3C=CC(=CC3)C)CC2)=CC=C1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915925