| SpectraBase Spectrum ID |
18mxBC0WzGJ |
| Name |
L-Isoleucyl-L-leucine, N-propoxycarbonyl-, propyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.262422262 u |
| Formula |
C19H36N2O5 |
| InChI |
InChI=1S/C19H36N2O5/c1-7-10-25-18(23)15(12-13(4)5)20-17(22)16(14(6)9-3)21-19(24)26-11-8-2/h13-16H,7-12H2,1-6H3,(H,20,22)(H,21,24) |
| InChIKey |
SIRDFXDVXBNOFD-UHFFFAOYSA-N |
| Molecular Weight |
372.506 g/mol |
| SMILES |
CCCOC(NC(C(NC(CC(C)C)C(OCCC)=O)=O)C(CC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834722 |
