| 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) Chemical Shifts
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| SpectraBase Spectrum ID | FjVZjCCS2X3 |
|---|---|
| Name | 1-hexadecyl-4-methylpyridinium benzenesulfonate |
| Copyright | Copyright © 2009-2024 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 | Varian CFT-20 |
| Sadtler NMR Number | 53024M |
| Solvent | CDCl3 |