| SpectraBase Spectrum ID |
DfGoVgXtBtk |
| Name |
L-Isoleucyl-L-alanine, N-methoxycarbonyl-, undecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.309372455 u |
| Formula |
C22H42N2O5 |
| InChI |
InChI=1S/C22H42N2O5/c1-6-8-9-10-11-12-13-14-15-16-29-21(26)18(4)23-20(25)19(17(3)7-2)24-22(27)28-5/h17-19H,6-16H2,1-5H3,(H,23,25)(H,24,27) |
| InChIKey |
NFPLXTWHFSZVHX-UHFFFAOYSA-N |
| Molecular Weight |
414.587 g/mol |
| SMILES |
C(C(NC(C(NC(OC)=O)C(CC)C)=O)C)(OCCCCCCCCCCC)=O |
