| SpectraBase Spectrum ID |
L9IzrqbxCc2 |
| Name |
L-Leucine, N-isobutoxycarbonyl-N-methyl-, isobutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
301.225308478 u |
| Formula |
C16H31NO4 |
| InChI |
InChI=1S/C16H31NO4/c1-11(2)8-14(15(18)20-9-12(3)4)17(7)16(19)21-10-13(5)6/h11-14H,8-10H2,1-7H3 |
| InChIKey |
JOMTYNZJCKLJBL-UHFFFAOYSA-N |
| SMILES |
CC(C)COC(N(C(C(OCC(C)C)=O)CC(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899137 |
