2-{4'-[N.N-bis(Chloroethyl)amino]phenyl}-2-(hydroxymethyl)-1,3-dioxobenzocyclopent-2-ene

SpectraBase Compound ID	F9jXqwxVZlu
InChI	InChI=1S/C20H19Cl2NO3/c21-9-11-23(12-10-22)15-7-5-14(6-8-15)20(13-24)18(25)16-3-1-2-4-17(16)19(20)26/h1-8,24H,9-13H2
InChIKey	MKVOFWLNNLQAQY-UHFFFAOYSA-N Google Search
Mol Weight	392.28 g/mol
Molecular Formula	C20H19Cl2NO3
Exact Mass	391.074199 g/mol

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SpectraBase Spectrum ID	9scKOXdEXXK
Name	2-[4-BIS(2-CHLOROETHYL)AMINOPHENYL]-2-HYDROXYMETHYLINDAN-1,3-DIONE
Comments	.4
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C20H19Cl2NO3
InChI	InChI=1S/C20H19Cl2NO3/c21-9-11-23(12-10-22)15-7-5-14(6-8-15)20(13-24)18(25)16-3-1-2-4-17(16)19(20)26/h1-8,24H,9-13H2
InChIKey	MKVOFWLNNLQAQY-UHFFFAOYSA-N
Instrument Name	Bruker AC-200
Literature Reference	L.M.PISARENKO, V.I.NIKULIN, N.N.SVESHNIKOV (1992) Izv.Akad.Nauk SSSR(Russ.Lang.): N11, 2609-2617.
NMR Standard	TMS
Origin	Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent	CDCl3 chloroform-d