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1-benzyl-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazinediium oxalate
SpectraBase Compound ID EzgLztzp4v5
InChI InChI=1S/C20H24N2O3.C2H2O4/c1-23-18-11-17(12-19-20(18)25-15-24-19)14-22-9-7-21(8-10-22)13-16-5-3-2-4-6-16;3-1(4)2(5)6/h2-6,11-12H,7-10,13-15H2,1H3;(H,3,4)(H,5,6)
InChIKey LGNSOGGRJFUSMX-UHFFFAOYSA-N
Mol Weight 430.46 g/mol
Molecular Formula C22H26N2O7
Exact Mass 430.174001 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1CNhUg3bvgj
Name 1-benzyl-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]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/C20H24N2O3.C2H2O4/c1-23-18-11-17(12-19-20(18)25-15-24-19)14-22-9-7-21(8-10-22)13-16-5-3-2-4-6-16;3-1(4)2(5)6/h2-6,11-12H,7-10,13-15H2,1H3;(H,3,4)(H,5,6)
InChIKey LGNSOGGRJFUSMX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17086
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/9030975; UBI_ID: UBI-017089
Temperature 308 °C