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5-(chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid

View entire compound with spectra: 1 NMR, and 1 FTIR

5-(chlorosulfonyl)-2-(hexadecylsulfonyl)benzoic acid
SpectraBase Compound ID 9ACs6owAoHq
InChI InChI=1S/C23H37ClO6S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-31(27,28)22-17-16-20(32(24,29)30)19-21(22)23(25)26/h16-17,19H,2-15,18H2,1H3,(H,25,26)
InChIKey XYGWPRXXAAOHQQ-UHFFFAOYSA-N
Mol Weight 509.1 g/mol
Molecular Formula C23H37ClO6S2
Exact Mass 508.172009 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IjCfigssZu4
Name 5-(CHLOROSULFONYL)-2-(HEXADECYLSULFONYL)BENZOIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S58268
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H37ClO6S2
InChI InChI=1S/C23H37ClO6S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-31(27,28)22-17-16-20(32(24,29)30)19-21(22)23(25)26/h16-17,19H,2-15,18H2,1H3,(H,25,26)
InChIKey XYGWPRXXAAOHQQ-UHFFFAOYSA-N
Molecular Weight 509.116180
Synonyms BENZOIC ACID, 5-/CHLOROSULFONYL/- 2-/HEXADECYLSULFONYL/-,
Technique FILM (CAST FROM CHCl3)