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1-(3-chlorobenzyl)-4-(3,5-dimethoxybenzyl)piperazinediium oxalate

View entire compound with spectra: 1 NMR

1-(3-chlorobenzyl)-4-(3,5-dimethoxybenzyl)piperazinediium oxalate
SpectraBase Compound ID BUnVF6Retdj
InChI InChI=1S/C20H25ClN2O2.C2H2O4/c1-24-19-11-17(12-20(13-19)25-2)15-23-8-6-22(7-9-23)14-16-4-3-5-18(21)10-16;3-1(4)2(5)6/h3-5,10-13H,6-9,14-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey RIQRRZNVRQOSNR-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

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SpectraBase Spectrum ID 2XwpdPu1IV9
Name 1-(3-chlorobenzyl)-4-(3,5-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/c1-24-19-11-17(12-20(13-19)25-2)15-23-8-6-22(7-9-23)14-16-4-3-5-18(21)10-16;3-1(4)2(5)6/h3-5,10-13H,6-9,14-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey RIQRRZNVRQOSNR-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8426
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/9030278; UBI_ID: UBI-008429
Temperature 313 °C