5-nitro-2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]benzenesulfonic acid

SpectraBase Compound ID	CAA4PApzUWa
InChI	InChI=1S/C20H25NO6S/c1-19(2,3)13-20(4,5)14-6-9-16(10-7-14)27-17-11-8-15(21(22)23)12-18(17)28(24,25)26/h6-12H,13H2,1-5H3,(H,24,25,26)
InChIKey	WCDGUQYZUYGEED-UHFFFAOYSA-N Google Search
Mol Weight	407.48 g/mol
Molecular Formula	C20H25NO6S
Exact Mass	407.140259 g/mol

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SpectraBase Spectrum ID	BE3m1xe7UF4
Name	5-NITRO-2-[p-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]BENZENESULFONIC ACID
Source of Sample	Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number	S50111
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H25NO6S
InChI	InChI=1S/C20H25NO6S/c1-19(2,3)13-20(4,5)14-6-9-16(10-7-14)27-17-11-8-15(21(22)23)12-18(17)28(24,25)26/h6-12H,13H2,1-5H3,(H,24,25,26)
InChIKey	WCDGUQYZUYGEED-UHFFFAOYSA-N
Molecular Weight	407.480988
Synonyms	BENZENESULFONIC ACID, 5-NITRO- 2-/P-/1,1,3,3-TETRAMETHYLBUTYL/PHEN- OXY/-,
Technique	FILM (CAST FROM CHCl3)