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1-(4-Chlorobenzyl)-4-(4-methoxyphenyl)piperazine

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

1-(4-Chlorobenzyl)-4-(4-methoxyphenyl)piperazine
SpectraBase Compound ID B3F6HycgMTS
InChI InChI=1S/C18H21ClN2O/c1-22-18-8-6-17(7-9-18)21-12-10-20(11-13-21)14-15-2-4-16(19)5-3-15/h2-9H,10-14H2,1H3
InChIKey LDFDADHJDLSZHP-UHFFFAOYSA-N
Mol Weight 316.83 g/mol
Molecular Formula C18H21ClN2O
Exact Mass 316.134241 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IcTP5cLdrGm
Name 1-(4-Chlorobenzyl)-4-(4-methoxyphenyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.134241003 u
Formula C18H21ClN2O
InChI InChI=1S/C18H21ClN2O/c1-22-18-8-6-17(7-9-18)21-12-10-20(11-13-21)14-15-2-4-16(19)5-3-15/h2-9H,10-14H2,1H3
InChIKey LDFDADHJDLSZHP-UHFFFAOYSA-N
Molecular Weight 316.832 g/mol
SMILES C=1(N2CCN(CC=3C=CC(=CC3)Cl)CC2)C=CC(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913441