Benzothiazolium, 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-2-methylphenyl]azo]-6-methyl-, chloride

SpectraBase Compound ID	1MW3kDC1xaR
InChI	InChI=1S/C22H27N5OS.ClH/c1-5-26(6-2)17-8-9-18(16(4)14-17)24-25-22-27(12-11-21(23)28)19-10-7-15(3)13-20(19)29-22;/h7-10,13-14H,5-6,11-12H2,1-4H3,(H-,23,28);1H
InChIKey	QNSGWCKKANVLDD-UHFFFAOYSA-N Google Search
Mol Weight	446.01 g/mol
Molecular Formula	C22H28ClN5OS
Exact Mass	445.170309 g/mol

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SpectraBase Spectrum ID	8lQaEoS14Kz
Name	Benzothiazolium, 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-2-methylphenyl]azo]-6-methyl-, chloride
CAS Registry Number	12221-39-5
Copyright	Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C22H28ClN5OS
InChI	InChI=1S/C22H27N5OS.ClH/c1-5-26(6-2)17-8-9-18(16(4)14-17)24-25-22-27(12-11-21(23)28)19-10-7-15(3)13-20(19)29-22;/h7-10,13-14H,5-6,11-12H2,1-4H3,(H-,23,28);1H
InChIKey	QNSGWCKKANVLDD-UHFFFAOYSA-N
Instrument Name	Bruker IFS 85
Technique	KBr-Pellet