| SpectraBase Spectrum ID |
3nlosXGj8Re |
| Name |
L-Leucine, N-neopentyloxycarbonyl-, propyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.209658414 u |
| Formula |
C15H29NO4 |
| InChI |
InChI=1S/C15H29NO4/c1-7-8-19-13(17)12(9-11(2)3)16-14(18)20-10-15(4,5)6/h11-12H,7-10H2,1-6H3,(H,16,18) |
| InChIKey |
YBDYUPOWZCYXTN-UHFFFAOYSA-N |
| SMILES |
CC(COC(NC(CC(C)C)C(OCCC)=O)=O)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930485 |
