| SpectraBase Spectrum ID |
1jxiYSQEKcf |
| Name |
L-Leucine, N-(N-propyloxycarbonyl)-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.147058156 u |
| Formula |
C11H21NO4 |
| InChI |
InChI=1S/C11H21NO4/c1-5-6-16-11(14)12-9(7-8(2)3)10(13)15-4/h8-9H,5-7H2,1-4H3,(H,12,14) |
| InChIKey |
SCKSDYKUZRJKHG-UHFFFAOYSA-N |
| Molecular Weight |
231.292 g/mol |
| SMILES |
C(C(C(OC)=O)NC(OCCC)=O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935063 |
