1-(3-chloro-p-tolyl)-4-{3-[p-(1,1,3,3-tetramethylbutyl)phenoxy]propyl}piperazine, monohydrochloride

SpectraBase Compound ID	JcOm34klFXb
InChI	InChI=1S/C28H41ClN2O.ClH/c1-22-8-11-24(20-26(22)29)31-17-15-30(16-18-31)14-7-19-32-25-12-9-23(10-13-25)28(5,6)21-27(2,3)4;/h8-13,20H,7,14-19,21H2,1-6H3;1H
InChIKey	JPQSEAPYKUMHNS-UHFFFAOYSA-N Google Search
Mol Weight	493.6 g/mol
Molecular Formula	C28H42Cl2N2O
Exact Mass	492.267419 g/mol

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SpectraBase Spectrum ID	GesfbG7lWmM
Name	1-(3-chloro-4-methylphenyl)-4-{3-[4-(1,1,3,3-tetramethylbutyl)phenoxy]propyl}piperazin-4-ium chloride
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C28H41ClN2O.ClH/c1-22-8-11-24(20-26(22)29)31-17-15-30(16-18-31)14-7-19-32-25-12-9-23(10-13-25)28(5,6)21-27(2,3)4;/h8-13,20H,7,14-19,21H2,1-6H3;1H
InChIKey	JPQSEAPYKUMHNS-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_17753
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 987/00006102; Labnumber: 987/00006102218875; VK_ID: VK-017759
Temperature	308 °C