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1-(3-nitrobenzyl)-4-(2,3,4-trimethoxybenzyl)piperazinediium oxalate

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1-(3-nitrobenzyl)-4-(2,3,4-trimethoxybenzyl)piperazinediium oxalate
SpectraBase Compound ID A4WzrNFBC4
InChI InChI=1S/C21H27N3O5.C2H2O4/c1-27-19-8-7-17(20(28-2)21(19)29-3)15-23-11-9-22(10-12-23)14-16-5-4-6-18(13-16)24(25)26;3-1(4)2(5)6/h4-8,13H,9-12,14-15H2,1-3H3;(H,3,4)(H,5,6)
InChIKey WWRLPTUGZAFARH-UHFFFAOYSA-N
Mol Weight 491.5 g/mol
Molecular Formula C23H29N3O9
Exact Mass 491.19038 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kltm0KeV6NV
Name 1-(3-nitrobenzyl)-4-(2,3,4-trimethoxybenzyl)piperazinediium oxalate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H27N3O5.C2H2O4/c1-27-19-8-7-17(20(28-2)21(19)29-3)15-23-11-9-22(10-12-23)14-16-5-4-6-18(13-16)24(25)26;3-1(4)2(5)6/h4-8,13H,9-12,14-15H2,1-3H3;(H,3,4)(H,5,6)
InChIKey WWRLPTUGZAFARH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12983
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/9030273; UBI_ID: UBI-012986
Temperature 318 °C