1-(3-bromo-4-methoxybenzyl)-4-[(4-chlorophenyl)sulfonyl]piperazine

SpectraBase Compound ID	BPcoXjciFKo
InChI	InChI=1S/C18H20BrClN2O3S/c1-25-18-7-2-14(12-17(18)19)13-21-8-10-22(11-9-21)26(23,24)16-5-3-15(20)4-6-16/h2-7,12H,8-11,13H2,1H3
InChIKey	QGQZFYLFBJFWDH-UHFFFAOYSA-N Google Search
Mol Weight	459.79 g/mol
Molecular Formula	C18H20BrClN2O3S
Exact Mass	458.006654 g/mol

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SpectraBase Spectrum ID	DvjE5QhVK2w
Name	1-(3-bromo-4-methoxybenzyl)-4-[(4-chlorophenyl)sulfonyl]piperazine
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/C18H20BrClN2O3S/c1-25-18-7-2-14(12-17(18)19)13-21-8-10-22(11-9-21)26(23,24)16-5-3-15(20)4-6-16/h2-7,12H,8-11,13H2,1H3
InChIKey	QGQZFYLFBJFWDH-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_20711
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/9312147; UBI_ID: UBI-020715
Synonyms	2-bromo-4-({4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl}methyl)phenyl methyl ether
Temperature	308 °C