2,7-Naphthalenedisulfonic acid, 3-[[4-(4,6-dimethyl-2-benzothiazolyl)-O-tolyl]azo]-5-ethoxy-4-hydroxy-, disodium salt

SpectraBase Compound ID	GhHTduBG4X8
InChI	InChI=1S/C28H25N3O8S3.2Na/c1-5-39-21-13-19(41(33,34)35)11-18-12-23(42(36,37)38)26(27(32)24(18)21)31-30-20-7-6-17(10-15(20)3)28-29-25-16(4)8-14(2)9-22(25)40-28;;/h6-13,32H,5H2,1-4H3,(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b31-30-;;
InChIKey	WGXGIOXBHKGQJZ-USQWWDFWSA-L Google Search
Mol Weight	671.66453856 g/mol
Molecular Formula	C28H23N3Na2O8S3
Exact Mass	671.044267 g/mol

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SpectraBase Spectrum ID	KsrDseMHf6Z
Name	2,7-Naphthalenedisulfonic acid, 3-[[4-(4,6-dimethyl-2-benzothiazolyl)-O-tolyl]azo]-5-ethoxy-4-hydroxy-, disodium salt
CAS Registry Number	5850-75-9
Copyright	Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C28H23N3Na2O8S3
InChI	InChI=1S/C28H25N3O8S3.2Na/c1-5-39-21-13-19(41(33,34)35)11-18-12-23(42(36,37)38)26(27(32)24(18)21)31-30-20-7-6-17(10-15(20)3)28-29-25-16(4)8-14(2)9-22(25)40-28;;/h6-13,32H,5H2,1-4H3,(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2/b31-30-;;
InChIKey	WGXGIOXBHKGQJZ-USQWWDFWSA-L
Instrument Name	Bruker IFS 85
Synonyms	2-(4-Amino-m-tolyl)-4,6-dimethylbenzothiazole->8-ethoxy-1-naphthol-3,6-disulfonacid, dinatrium salt
Technique	KBr-Pellet