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3-((4-(3-chlorobenzyl)piperazin-1-yl)methyl)-1H-indole oxalate

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3-((4-(3-chlorobenzyl)piperazin-1-yl)methyl)-1H-indole oxalate
SpectraBase Compound ID 48LcP4eGfXZ
InChI InChI=1S/C20H22ClN3.C2H2O4/c21-18-5-3-4-16(12-18)14-23-8-10-24(11-9-23)15-17-13-22-20-7-2-1-6-19(17)20;3-1(4)2(5)6/h1-7,12-13,22H,8-11,14-15H2;(H,3,4)(H,5,6)
InChIKey PZGYCOHOPLQMRC-UHFFFAOYSA-N
Mol Weight 429.9 g/mol
Molecular Formula C22H24ClN3O4
Exact Mass 429.145534 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 51Ug7bKNGIL
Name 1-(3-chlorobenzyl)-4-(1H-indol-3-ylmethyl)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/C20H22ClN3.C2H2O4/c21-18-5-3-4-16(12-18)14-23-8-10-24(11-9-23)15-17-13-22-20-7-2-1-6-19(17)20;3-1(4)2(5)6/h1-7,12-13,22H,8-11,14-15H2;(H,3,4)(H,5,6)
InChIKey PZGYCOHOPLQMRC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17049
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/9030129; UBI_ID: UBI-017052
Temperature 318 °C