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1-[4-(2-chloro-5-methylphenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride
SpectraBase Compound ID 5VhWAKlmluX
InChI InChI=1S/C22H29ClN2O2.ClH/c1-18-9-10-19(23)22(17-18)27-16-6-5-11-24-12-14-25(15-13-24)20-7-3-4-8-21(20)26-2;/h3-4,7-10,17H,5-6,11-16H2,1-2H3;1H
InChIKey GZNQQLHYEPHOSP-UHFFFAOYSA-N
Mol Weight 425.4 g/mol
Molecular Formula C22H30Cl2N2O2
Exact Mass 424.168434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5fGAUga5X8a
Name 1-[4-(2-chloro-5-methylphenoxy)butyl]-4-(2-methoxyphenyl)piperazin-1-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/C22H29ClN2O2.ClH/c1-18-9-10-19(23)22(17-18)27-16-6-5-11-24-12-14-25(15-13-24)20-7-3-4-8-21(20)26-2;/h3-4,7-10,17H,5-6,11-16H2,1-2H3;1H
InChIKey GZNQQLHYEPHOSP-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_434
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: 602457PSNS1-0656; Labnumber: 602457PSNS1-0656; VK_ID: VK-000435
Temperature 313 °C