1H-Pyrazole-3-carboxylic acid, 4-[(2-chlorophenyl)azo]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, 3-ethyl ester, sodium salt

SpectraBase Compound ID	5CM1CPicqsO
InChI	InChI=1S/C18H15ClN4O6S.Na/c1-2-29-18(25)16-15(21-20-14-6-4-3-5-13(14)19)17(24)23(22-16)11-7-9-12(10-8-11)30(26,27)28;/h3-10,24H,2H2,1H3,(H,26,27,28);/q;+1/p-1/b21-20+;
InChIKey	JADTUPVFESWNCK-ANVLNOONSA-M Google Search
Mol Weight	472.83476928 g/mol
Molecular Formula	C18H14ClN4NaO6S
Exact Mass	472.022027 g/mol

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SpectraBase Spectrum ID	BlaU9O52ivK
Name	1H-Pyrazole-3-carboxylic acid, 4-[(2-chlorophenyl)azo]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, 3-ethyl ester, sodium salt
CAS Registry Number	6442-02-0
Copyright	Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C18H14ClN4NaO6S
InChI	InChI=1S/C18H15ClN4O6S.Na/c1-2-29-18(25)16-15(21-20-14-6-4-3-5-13(14)19)17(24)23(22-16)11-7-9-12(10-8-11)30(26,27)28;/h3-10,24H,2H2,1H3,(H,26,27,28);/q;+1/p-1/b21-20+;
InChIKey	JADTUPVFESWNCK-ANVLNOONSA-M
Instrument Name	Bruker IFS 85
Technique	KBr-Pellet