| SpectraBase Spectrum ID |
6AU0lWnFj0O |
| Name |
Glycine, 2-cyclohexyl-N-ethoxycarbonyl-, octadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
481.413109251 u |
| Formula |
C29H55NO4 |
| InChI |
InChI=1S/C29H55NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-34-28(31)27(30-29(32)33-4-2)26-23-20-19-21-24-26/h26-27H,3-25H2,1-2H3,(H,30,32) |
| InChIKey |
NJJUNYWHCRZBQW-UHFFFAOYSA-N |
| Molecular Weight |
481.762 g/mol |
| SMILES |
C1CC(CCC1)C(NC(=O)OCC)C(OCCCCCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893941 |
