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4-(hexadecylsulfonyl)-3-nitrobenzoic acid, methyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

4-(hexadecylsulfonyl)-3-nitrobenzoic acid, methyl ester
SpectraBase Compound ID KS7QNbXV5cs
InChI InChI=1S/C24H39NO6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-32(29,30)23-18-17-21(24(26)31-2)20-22(23)25(27)28/h17-18,20H,3-16,19H2,1-2H3
InChIKey FHENETBSHDMRNE-UHFFFAOYSA-N
Mol Weight 469.6 g/mol
Molecular Formula C24H39NO6S
Exact Mass 469.249809 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1Gm4K7uzDQt
Name 4-(HEXADECYLSULFONYL)-3-NITROBENZOIC ACID, METHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S38926
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H39NO6S
InChI InChI=1S/C24H39NO6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-32(29,30)23-18-17-21(24(26)31-2)20-22(23)25(27)28/h17-18,20H,3-16,19H2,1-2H3
InChIKey FHENETBSHDMRNE-UHFFFAOYSA-N
Molecular Weight 469.636993
Synonyms BENZOIC ACID, 4-/HEXADECYL- SULFONYL/-3-NITRO-, METHYL ESTER
Technique FILM (CAST FROM CHCl3)