| SpectraBase Spectrum ID |
6jiUMqqciH8 |
| Name |
Glycine, 2-cyclohexyl-N-propoxycarbonyl-, octadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
495.428759315 u |
| Formula |
C30H57NO4 |
| InChI |
InChI=1S/C30H57NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-26-34-29(32)28(27-23-20-19-21-24-27)31-30(33)35-25-4-2/h27-28H,3-26H2,1-2H3,(H,31,33) |
| InChIKey |
VDTUWJMIIQLZNR-UHFFFAOYSA-N |
| Molecular Weight |
495.789 g/mol |
| SMILES |
C1CC(CCC1)C(NC(=O)OCCC)C(OCCCCCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901067 |
