| SpectraBase Spectrum ID |
JYfQtQ7EEBw |
| Name |
Alanylalanine, N,N'-dimethyl-N'-allyloxycarbonyl-, pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
482.371972713 u |
| Formula |
C27H50N2O5 |
| InChI |
InChI=1S/C27H50N2O5/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-22-33-26(31)24(4)28(5)25(30)23(3)29(6)27(32)34-21-8-2/h8,23-24H,2,7,9-22H2,1,3-6H3 |
| InChIKey |
WHZAZWULQVGSEI-UHFFFAOYSA-N |
| Molecular Weight |
482.706 g/mol |
| SMILES |
C=CCOC(N(C(C(N(C(C(OCCCCCCCCCCCCCCC)=O)C)C)=O)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812444 |
