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1-(3,4-dimethoxybenzyl)-4-(3-pyridinylmethyl)piperazinediium oxalate

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1-(3,4-dimethoxybenzyl)-4-(3-pyridinylmethyl)piperazinediium oxalate
SpectraBase Compound ID ADsQESgdAU5
InChI InChI=1S/C19H25N3O2.C2H2O4/c1-23-18-6-5-16(12-19(18)24-2)14-21-8-10-22(11-9-21)15-17-4-3-7-20-13-17;3-1(4)2(5)6/h3-7,12-13H,8-11,14-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey DECFUDIISOSNJH-UHFFFAOYSA-N
Mol Weight 417.46 g/mol
Molecular Formula C21H27N3O6
Exact Mass 417.189986 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID f9INSISE9r
Name 1-(3,4-dimethoxybenzyl)-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/C19H25N3O2.C2H2O4/c1-23-18-6-5-16(12-19(18)24-2)14-21-8-10-22(11-9-21)15-17-4-3-7-20-13-17;3-1(4)2(5)6/h3-7,12-13H,8-11,14-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey DECFUDIISOSNJH-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17052
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/9030229; UBI_ID: UBI-017055
Temperature 313 °C