| SpectraBase Spectrum ID |
66DkrXSwy2D |
| Name |
L-Leucine, N-isopropyloxycarbonyl-, 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/c1-7(2)6-9(10(13)15-5)12-11(14)16-8(3)4/h7-9H,6H2,1-5H3,(H,12,14) |
| InChIKey |
PPTHUCRFGLHYLM-UHFFFAOYSA-N |
| Molecular Weight |
231.292 g/mol |
| SMILES |
C(C(C(OC)=O)NC(OC(C)C)=O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967926 |
