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1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-methoxybenzyl)piperazinediium oxalate

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1-(1,3-Benzodioxol-5-ylmethyl)-4-(4-methoxybenzyl)piperazinediium oxalate
SpectraBase Compound ID 7U6nD1H7RHg
InChI InChI=1S/C20H24N2O3.C2H2O4/c1-23-18-5-2-16(3-6-18)13-21-8-10-22(11-9-21)14-17-4-7-19-20(12-17)25-15-24-19;3-1(4)2(5)6/h2-7,12H,8-11,13-15H2,1H3;(H,3,4)(H,5,6)
InChIKey AETQFNPSYDZJCD-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 b1QUJ4UGVd
Name 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxybenzyl)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/C20H24N2O3.C2H2O4/c1-23-18-5-2-16(3-6-18)13-21-8-10-22(11-9-21)14-17-4-7-19-20(12-17)25-15-24-19;3-1(4)2(5)6/h2-7,12H,8-11,13-15H2,1H3;(H,3,4)(H,5,6)
InChIKey AETQFNPSYDZJCD-UHFFFAOYSA-N
NMR Offset 15.3255
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8421
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/9030133; UBI_ID: UBI-008424
Temperature 318 °C