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1-(1H-indol-3-ylmethyl)-4-(2,3,4-trimethoxybenzyl)piperazinediium oxalate

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1-(1H-indol-3-ylmethyl)-4-(2,3,4-trimethoxybenzyl)piperazinediium oxalate
SpectraBase Compound ID FY9pmW2U7NT
InChI InChI=1S/C23H29N3O3.C2H2O4/c1-27-21-9-8-17(22(28-2)23(21)29-3)15-25-10-12-26(13-11-25)16-18-14-24-20-7-5-4-6-19(18)20;3-1(4)2(5)6/h4-9,14,24H,10-13,15-16H2,1-3H3;(H,3,4)(H,5,6)
InChIKey OKQKEHCRUPTWCS-UHFFFAOYSA-N
Mol Weight 485.54 g/mol
Molecular Formula C25H31N3O7
Exact Mass 485.2162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I2gv1fMCRfd
Name 1-(1H-indol-3-ylmethyl)-4-(2,3,4-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/C23H29N3O3.C2H2O4/c1-27-21-9-8-17(22(28-2)23(21)29-3)15-25-10-12-26(13-11-25)16-18-14-24-20-7-5-4-6-19(18)20;3-1(4)2(5)6/h4-9,14,24H,10-13,15-16H2,1-3H3;(H,3,4)(H,5,6)
InChIKey OKQKEHCRUPTWCS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12978
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/9030188; UBI_ID: UBI-012981
Temperature 318 °C