For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(3-chlorobenzyl)-4-(2,4-dimethoxybenzyl)piperazinediium oxalate

View entire compound with spectra: 1 NMR

1-(3-chlorobenzyl)-4-(2,4-dimethoxybenzyl)piperazinediium oxalate
SpectraBase Compound ID GbIRBWPS6L8
InChI InChI=1S/C20H25ClN2O2.C2H2O4/c1-24-19-7-6-17(20(13-19)25-2)15-23-10-8-22(9-11-23)14-16-4-3-5-18(21)12-16;3-1(4)2(5)6/h3-7,12-13H,8-11,14-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey DESPORPDTWTKER-UHFFFAOYSA-N
Mol Weight 450.92 g/mol
Molecular Formula C22H27ClN2O6
Exact Mass 450.155764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CASMjEa79Gn
Name 1-(3-chlorobenzyl)-4-(2,4-dimethoxybenzyl)piperazinediium oxalate
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/C20H25ClN2O2.C2H2O4/c1-24-19-7-6-17(20(13-19)25-2)15-23-10-8-22(9-11-23)14-16-4-3-5-18(21)12-16;3-1(4)2(5)6/h3-7,12-13H,8-11,14-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey DESPORPDTWTKER-UHFFFAOYSA-N
NMR Offset 18.416
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_17073
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: UZI/9030621; UBI_ID: UBI-017076
Temperature 313 °C