| SpectraBase Spectrum ID |
9OBNnwMGXuZ |
| Name |
Glycine, 2-cyclohexyl-N-(2-ethylhexyl)oxycarbonyl-, butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.287908736 u |
| Formula |
C21H39NO4 |
| InChI |
InChI=1S/C21H39NO4/c1-4-7-12-17(6-3)16-26-21(24)22-19(18-13-10-9-11-14-18)20(23)25-15-8-5-2/h17-19H,4-16H2,1-3H3,(H,22,24) |
| InChIKey |
SFBVDFVLXHBXTJ-UHFFFAOYSA-N |
| Molecular Weight |
369.546 g/mol |
| SMILES |
C1CC(CCC1)C(NC(=O)OCC(CC)CCCC)C(OCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952793 |
