| SpectraBase Spectrum ID |
KeXNk3NuoC5 |
| Name |
Cyclohexyl-(2-mesyl-2-methyl-1-phenyl-propyl)amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.176250285 u |
| Formula |
C17H27NO2S |
| InChI |
InChI=1S/C17H27NO2S/c1-17(2,21(3,19)20)16(14-10-6-4-7-11-14)18-15-12-8-5-9-13-15/h4,6-7,10-11,15-16,18H,5,8-9,12-13H2,1-3H3 |
| InChIKey |
DOCVYZUXJQTIDM-UHFFFAOYSA-N |
| Molecular Weight |
309.468 g/mol |
| SMILES |
C(S(=O)(=O)C)(C(NC1CCCCC1)C1=CC=CC=C1)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886637 |
