| SpectraBase Spectrum ID |
2cFvjRPhqAc |
| Name |
N-(1-tert-Butyl-4,4-diethoxy-1-octylbut-2-ynyl)-4-toluenesulfonamide |
| Comments |
Note: The molecular formula of the structure shown is C27H45NO4S - which differs from the formula reported for the mass spectrum (C19H29NO4S) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H29NO4S |
| InChI |
InChI=1S/C27H45NO4S/c1-8-11-12-13-14-15-21-27(26(5,6)7,22-20-25(31-9-2)32-10-3)28-33(29,30)24-18-16-23(4)17-19-24/h16-19,25,28H,8-15,21H2,1-7H3 |
| InChIKey |
PTXFVYXOUWDIJY-UHFFFAOYSA-N |
| Molecular Weight |
479.720 g/mol |
| SMILES |
N(C(C(C)(C)C)(C#CC(OCC)OCC)CCCCCCCC)S(=O)(=O)c1ccc(cc1)C |
| SPLASH |
splash10-0nml-7910000000-230d76b9a9424f393a58 |
| Source of Spectrum |
SO-0-282-14 |
| Wiley ID |
872920 |
