| SpectraBase Spectrum ID |
5TVbJBqEFBZ |
| Name |
Glycine, 2-cyclohexyl-N-(2-ethylhexyl)oxycarbonyl-, hexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.319208865 u |
| Formula |
C23H43NO4 |
| InChI |
InChI=1S/C23H43NO4/c1-4-7-9-13-17-27-22(25)21(20-15-11-10-12-16-20)24-23(26)28-18-19(6-3)14-8-5-2/h19-21H,4-18H2,1-3H3,(H,24,26) |
| InChIKey |
SVTOHDHCKCCVMY-UHFFFAOYSA-N |
| Molecular Weight |
397.600 g/mol |
| SMILES |
C1CC(CCC1)C(NC(=O)OCC(CC)CCCC)C(OCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962684 |
