1-(2-chlorobenzyl)-4-[(9-ethyl-9H-carbazol-3-yl)methyl]piperazinediium oxalate

SpectraBase Compound ID	HbGx3uZ9UvV
InChI	InChI=1S/C26H28ClN3.C2H2O4/c1-2-30-25-10-6-4-8-22(25)23-17-20(11-12-26(23)30)18-28-13-15-29(16-14-28)19-21-7-3-5-9-24(21)27;3-1(4)2(5)6/h3-12,17H,2,13-16,18-19H2,1H3;(H,3,4)(H,5,6)
InChIKey	MDSBAWKLBUKCME-UHFFFAOYSA-N Google Search
Mol Weight	508.02 g/mol
Molecular Formula	C28H30ClN3O4
Exact Mass	507.192484 g/mol

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SpectraBase Spectrum ID	8K8gsIxw1Qv
Name	1-(2-chlorobenzyl)-4-[(9-ethyl-9H-carbazol-3-yl)methyl]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/C26H28ClN3.C2H2O4/c1-2-30-25-10-6-4-8-22(25)23-17-20(11-12-26(23)30)18-28-13-15-29(16-14-28)19-21-7-3-5-9-24(21)27;3-1(4)2(5)6/h3-12,17H,2,13-16,18-19H2,1H3;(H,3,4)(H,5,6)
InChIKey	MDSBAWKLBUKCME-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_8470
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/9031057; UBI_ID: UBI-008473
Temperature	318 °C