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1-(2-Methylphenyl)-4-(3-trifluoromethylbenzyl)piperazine

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

1-(2-Methylphenyl)-4-(3-trifluoromethylbenzyl)piperazine
SpectraBase Compound ID IcmRsfAX7mr
InChI InChI=1S/C19H21F3N2/c1-15-5-2-3-8-18(15)24-11-9-23(10-12-24)14-16-6-4-7-17(13-16)19(20,21)22/h2-8,13H,9-12,14H2,1H3
InChIKey HVKAQIOXSCJNHG-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 AdPsus7zbMN
Name 1-(2-Methylphenyl)-4-(3-trifluoromethylbenzyl)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/c1-15-5-2-3-8-18(15)24-11-9-23(10-12-24)14-16-6-4-7-17(13-16)19(20,21)22/h2-8,13H,9-12,14H2,1H3
InChIKey HVKAQIOXSCJNHG-UHFFFAOYSA-N
Molecular Weight 334.386 g/mol
SMILES C1(N2CCN(CC=3C=C(C(F)(F)F)C=CC3)CC2)=C(C=CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906071