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1-(1H-indol-3-ylmethyl)-4-(4-methylbenzyl)piperazinediium oxalate

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1-(1H-indol-3-ylmethyl)-4-(4-methylbenzyl)piperazinediium oxalate
SpectraBase Compound ID FQ7VXmHfGAl
InChI InChI=1S/C21H25N3.C2H2O4/c1-17-6-8-18(9-7-17)15-23-10-12-24(13-11-23)16-19-14-22-21-5-3-2-4-20(19)21;3-1(4)2(5)6/h2-9,14,22H,10-13,15-16H2,1H3;(H,3,4)(H,5,6)
InChIKey LJGVTZAXDJFESL-UHFFFAOYSA-N
Mol Weight 409.49 g/mol
Molecular Formula C23H27N3O4
Exact Mass 409.200156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1Msl6HYhnSk
Name 1-(1H-indol-3-ylmethyl)-4-(4-methylbenzyl)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/C21H25N3.C2H2O4/c1-17-6-8-18(9-7-17)15-23-10-12-24(13-11-23)16-19-14-22-21-5-3-2-4-20(19)21;3-1(4)2(5)6/h2-9,14,22H,10-13,15-16H2,1H3;(H,3,4)(H,5,6)
InChIKey LJGVTZAXDJFESL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13027
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/9030844; UBI_ID: UBI-013030
Temperature 318 °C