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1-(4-Fluorophenyl)-4-(3-trifluoromethylbenzyl)piperazine

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

1-(4-Fluorophenyl)-4-(3-trifluoromethylbenzyl)piperazine
SpectraBase Compound ID IO5YFSvcu75
InChI InChI=1S/C18H18F4N2/c19-16-4-6-17(7-5-16)24-10-8-23(9-11-24)13-14-2-1-3-15(12-14)18(20,21)22/h1-7,12H,8-11,13H2
InChIKey JDOHALNZXSRDPZ-UHFFFAOYSA-N
Mol Weight 338.35 g/mol
Molecular Formula C18H18F4N2
Exact Mass 338.140611 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8236JcODPds
Name 1-(4-Fluorophenyl)-4-(3-trifluoromethylbenzyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.140611240 u
Formula C18H18F4N2
InChI InChI=1S/C18H18F4N2/c19-16-4-6-17(7-5-16)24-10-8-23(9-11-24)13-14-2-1-3-15(12-14)18(20,21)22/h1-7,12H,8-11,13H2
InChIKey JDOHALNZXSRDPZ-UHFFFAOYSA-N
Molecular Weight 338.350 g/mol
SMILES C(C1=CC(CN2CCN(C=3C=CC(=CC3)F)CC2)=CC=C1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.909092