| SpectraBase Spectrum ID |
DSOvXzOnkZ4 |
| Name |
Alanine, N-methyl-N-butoxycarbonyl-, dodecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.303558800 u |
| Formula |
C21H41NO4 |
| InChI |
InChI=1S/C21H41NO4/c1-5-7-9-10-11-12-13-14-15-16-18-25-20(23)19(3)22(4)21(24)26-17-8-6-2/h19H,5-18H2,1-4H3 |
| InChIKey |
PLFGSKGRBQIYDS-UHFFFAOYSA-N |
| Molecular Weight |
371.562 g/mol |
| SMILES |
CCCCOC(N(C(C(OCCCCCCCCCCCC)=O)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817696 |
