| SpectraBase Spectrum ID |
EH0qvd3DuMn |
| Name |
L-Leucyl-L-leucine, N-propargyloxycarbonyl-, heptyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
424.293722391 u |
| Formula |
C23H40N2O5 |
| InChI |
InChI=1S/C23H40N2O5/c1-7-9-10-11-12-14-29-22(27)20(16-18(5)6)24-21(26)19(15-17(3)4)25-23(28)30-13-8-2/h2,17-20H,7,9-16H2,1,3-6H3,(H,24,26)(H,25,28) |
| InChIKey |
YBCBPVCHLLHGAX-UHFFFAOYSA-N |
| Molecular Weight |
424.582 g/mol |
| SMILES |
C#CCOC(NC(C(NC(C(OCCCCCCC)=O)CC(C)C)=O)CC(C)C)=O |
