piperazinediium, 1-[3-[(2,5-dimethylphenyl)amino]-3-oxopropyl]-4-[(2E)-3-phenyl-2-propenyl]-, dichloride

SpectraBase Compound ID	FFO9NVMtjRO
InChI	InChI=1S/C24H31N3O.2ClH/c1-20-10-11-21(2)23(19-20)25-24(28)12-14-27-17-15-26(16-18-27)13-6-9-22-7-4-3-5-8-22;;/h3-11,19H,12-18H2,1-2H3,(H,25,28);2*1H/b9-6+;;
InChIKey	ZFBHJBPVILDDAG-SWSRPJROSA-N Google Search
Mol Weight	450.45 g/mol
Molecular Formula	C24H33Cl2N3O
Exact Mass	449.200068 g/mol

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SpectraBase Spectrum ID	KLVR2BbjIjM
Name	piperazinediium, 1-[3-[(2,5-dimethylphenyl)amino]-3-oxopropyl]-4-[(2E)-3-phenyl-2-propenyl]-, dichloride
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/C24H31N3O.2ClH/c1-20-10-11-21(2)23(19-20)25-24(28)12-14-27-17-15-26(16-18-27)13-6-9-22-7-4-3-5-8-22;;/h3-11,19H,12-18H2,1-2H3,(H,25,28);2*1H/b9-6+;;
InChIKey	ZFBHJBPVILDDAG-SWSRPJROSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_105
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: NMR/11219708