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

*Links on SpectraBase are not permalinks.

1-(2-chlorobenzyl)-4-(4,5-dimethoxy-2-nitrobenzyl)piperazinediium oxalate

View entire compound with spectra: 1 NMR

1-(2-chlorobenzyl)-4-(4,5-dimethoxy-2-nitrobenzyl)piperazinediium oxalate
SpectraBase Compound ID 3tYDXjTbnl8
InChI InChI=1S/C20H24ClN3O4.C2H2O4/c1-27-19-11-16(18(24(25)26)12-20(19)28-2)14-23-9-7-22(8-10-23)13-15-5-3-4-6-17(15)21;3-1(4)2(5)6/h3-6,11-12H,7-10,13-14H2,1-2H3;(H,3,4)(H,5,6)
InChIKey JNTOLRJFKHDGGE-UHFFFAOYSA-N
Mol Weight 495.92 g/mol
Molecular Formula C22H26ClN3O8
Exact Mass 495.140843 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 2650W0Rvv5m
Name 1-(2-chlorobenzyl)-4-(4,5-dimethoxy-2-nitrobenzyl)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/C20H24ClN3O4.C2H2O4/c1-27-19-11-16(18(24(25)26)12-20(19)28-2)14-23-9-7-22(8-10-23)13-15-5-3-4-6-17(15)21;3-1(4)2(5)6/h3-6,11-12H,7-10,13-14H2,1-2H3;(H,3,4)(H,5,6)
InChIKey JNTOLRJFKHDGGE-UHFFFAOYSA-N
NMR Offset 18.416
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_17095
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/9031160; UBI_ID: UBI-017098
Temperature 313 °C