| SpectraBase Spectrum ID |
7p9vWHl2UWz |
| Name |
L-Alanine, N-(cyclopentylcarbonyl)-, dodecyl 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/c1-3-4-5-6-7-8-9-10-11-14-17-25-21(24)18(2)22-20(23)19-15-12-13-16-19/h18-19H,3-17H2,1-2H3,(H,22,23) |
| InChIKey |
FNYFDNHOEQEYSR-UHFFFAOYSA-N |
| Molecular Weight |
353.547 g/mol |
| SMILES |
C1CCCC1C(=O)NC(C(OCCCCCCCCCCCC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896624 |
