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1-(4,5-dimethoxy-2-nitrobenzyl)-4-(3-pyridinylmethyl)piperazinediium oxalate
SpectraBase Compound ID Kt1FBPxq52x
InChI InChI=1S/C19H24N4O4.C2H2O4/c1-26-18-10-16(17(23(24)25)11-19(18)27-2)14-22-8-6-21(7-9-22)13-15-4-3-5-20-12-15;3-1(4)2(5)6/h3-5,10-12H,6-9,13-14H2,1-2H3;(H,3,4)(H,5,6)
InChIKey WAZPTHIIINDITA-UHFFFAOYSA-N
Mol Weight 462.46 g/mol
Molecular Formula C21H26N4O8
Exact Mass 462.175064 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CQnNMdDKjVx
Name 1-(4,5-dimethoxy-2-nitrobenzyl)-4-(3-pyridinylmethyl)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/C19H24N4O4.C2H2O4/c1-26-18-10-16(17(23(24)25)11-19(18)27-2)14-22-8-6-21(7-9-22)13-15-4-3-5-20-12-15;3-1(4)2(5)6/h3-5,10-12H,6-9,13-14H2,1-2H3;(H,3,4)(H,5,6)
InChIKey WAZPTHIIINDITA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13053
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/9031173; UBI_ID: UBI-013056
Temperature 318 °C