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1-(3-methylbenzyl)-4-(3,4,5-trimethoxybenzyl)piperazinediium oxalate

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1-(3-methylbenzyl)-4-(3,4,5-trimethoxybenzyl)piperazinediium oxalate
SpectraBase Compound ID LCSDHbbw0zz
InChI InChI=1S/C22H30N2O3.C2H2O4/c1-17-6-5-7-18(12-17)15-23-8-10-24(11-9-23)16-19-13-20(25-2)22(27-4)21(14-19)26-3;3-1(4)2(5)6/h5-7,12-14H,8-11,15-16H2,1-4H3;(H,3,4)(H,5,6)
InChIKey KAJKYIDKYDKJSX-UHFFFAOYSA-N
Mol Weight 460.5 g/mol
Molecular Formula C24H32N2O7
Exact Mass 460.220951 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LSmUN1ob9T1
Name 1-(3-methylbenzyl)-4-(3,4,5-trimethoxybenzyl)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/C22H30N2O3.C2H2O4/c1-17-6-5-7-18(12-17)15-23-8-10-24(11-9-23)16-19-13-20(25-2)22(27-4)21(14-19)26-3;3-1(4)2(5)6/h5-7,12-14H,8-11,15-16H2,1-4H3;(H,3,4)(H,5,6)
InChIKey KAJKYIDKYDKJSX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17036
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/9029794; UBI_ID: UBI-017039
Temperature 318 °C