2-((E)-{[4-(4-chlorobenzyl)-1-piperazinyl]imino}methyl)-4,6-diiodophenol

SpectraBase Compound ID	5XbPrSYcQ8Z
InChI	InChI=1S/C18H18ClI2N3O/c19-15-3-1-13(2-4-15)12-23-5-7-24(8-6-23)22-11-14-9-16(20)10-17(21)18(14)25/h1-4,9-11,25H,5-8,12H2/b22-11+
InChIKey	AFCQOTHFIOPJJT-SSDVNMTOSA-N Google Search
Mol Weight	581.62 g/mol
Molecular Formula	C18H18ClI2N3O
Exact Mass	580.92278 g/mol

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SpectraBase Spectrum ID	FBKncWkjAz6
Name	2-((E)-{[4-(4-chlorobenzyl)-1-piperazinyl]imino}methyl)-4,6-diiodophenol
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/C18H18ClI2N3O/c19-15-3-1-13(2-4-15)12-23-5-7-24(8-6-23)22-11-14-9-16(20)10-17(21)18(14)25/h1-4,9-11,25H,5-8,12H2/b22-11+
InChIKey	AFCQOTHFIOPJJT-SSDVNMTOSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3577
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: D12954; Labnumber: GRES-00986; SBI_ID: SBI-003579
Synonyms	2-({[4-(4-chlorobenzyl)-1-piperazinyl]imino}methyl)-4,6-diiodophenol
Temperature	315 °C