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

SpectraBase Compound ID	7YC0aZrkIKW
InChI	InChI=1S/C27H31N3.C2H2O4/c1-3-30-26-10-5-4-9-24(26)25-18-23(11-12-27(25)30)20-29-15-13-28(14-16-29)19-22-8-6-7-21(2)17-22;3-1(4)2(5)6/h4-12,17-18H,3,13-16,19-20H2,1-2H3;(H,3,4)(H,5,6)
InChIKey	DOEQUBAGGHFXMY-UHFFFAOYSA-N Google Search
Mol Weight	487.6 g/mol
Molecular Formula	C29H33N3O4
Exact Mass	487.247107 g/mol

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SpectraBase Spectrum ID	5Y2NLkUrbU6
Name	1-[(9-ethyl-9H-carbazol-3-yl)methyl]-4-(3-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/C27H31N3.C2H2O4/c1-3-30-26-10-5-4-9-24(26)25-18-23(11-12-27(25)30)20-29-15-13-28(14-16-29)19-22-8-6-7-21(2)17-22;3-1(4)2(5)6/h4-12,17-18H,3,13-16,19-20H2,1-2H3;(H,3,4)(H,5,6)
InChIKey	DOEQUBAGGHFXMY-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_8460
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/9030851; UBI_ID: UBI-008463
Temperature	318 °C