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piperidinium, 4-[[[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]ammonio]methyl]-, dichloride
SpectraBase Compound ID GWir7vOo1DH
InChI InChI=1S/C21H27ClN2O2.2ClH/c1-25-20-4-2-3-18(14-24-13-16-9-11-23-12-10-16)21(20)26-15-17-5-7-19(22)8-6-17;;/h2-8,16,23-24H,9-15H2,1H3;2*1H
InChIKey ITCPXEYUNCPNQY-UHFFFAOYSA-N
Mol Weight 447.83 g/mol
Molecular Formula C21H29Cl3N2O2
Exact Mass 446.129461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2O0RlBipgAz
Name piperidinium, 4-[[[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]ammonio]methyl]-, dichloride
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/C21H27ClN2O2.2ClH/c1-25-20-4-2-3-18(14-24-13-16-9-11-23-12-10-16)21(20)26-15-17-5-7-19(22)8-6-17;;/h2-8,16,23-24H,9-15H2,1H3;2*1H
InChIKey ITCPXEYUNCPNQY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3656
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: F18028; Labnumber: SPHRAM1-35221