| SpectraBase Spectrum ID |
5tPic99hsEz |
| Name |
L-Proline, N-pivaloyl-, undecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
353.292994117 u |
| Formula |
C21H39NO3 |
| InChI |
InChI=1S/C21H39NO3/c1-5-6-7-8-9-10-11-12-13-17-25-19(23)18-15-14-16-22(18)20(24)21(2,3)4/h18H,5-17H2,1-4H3 |
| InChIKey |
APUZBAIHSOYBAO-UHFFFAOYSA-N |
| Molecular Weight |
353.547 g/mol |
| SMILES |
CC(C(N1CCCC1C(=O)OCCCCCCCCCCC)=O)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875496 |
