For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-hexadecyl-4-methylpyridinium benzenesulfonate

View entire compound with spectra: 2 NMR, and 1 FTIR

1-hexadecyl-4-methylpyridinium benzenesulfonate
SpectraBase Compound ID Bq1BCG4gzgy
InChI InChI=1S/C22H40N.C6H6O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-20-17-22(2)18-21-23;7-10(8,9)6-4-2-1-3-5-6/h17-18,20-21H,3-16,19H2,1-2H3;1-5H,(H,7,8,9)/q+1;/p-1
InChIKey DZPDSLZMMYYZGU-UHFFFAOYSA-M
Mol Weight 475.73 g/mol
Molecular Formula C28H45NO3S
Exact Mass 475.312015 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Fh9MinEkjq
Name 1-HEXADECYL-4-METHYLPYRIDINIUM BENZENESULFONATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H45NO3S
InChI InChI=1S/C22H40N.C6H6O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-20-17-22(2)18-21-23;7-10(8,9)6-4-2-1-3-5-6/h17-18,20-21H,3-16,19H2,1-2H3;1-5H,(H,7,8,9)/q+1;/p-1
InChIKey DZPDSLZMMYYZGU-UHFFFAOYSA-M
Instrument Name BRUKER AC-300
Molecular Weight 475.74
Solvent CDCl3; Reference=TMS; Temperature 297K