| SpectraBase Spectrum ID |
C4YuvFuqpTr |
| Name |
L-Leucine, N-(2-methoxyethoxycarbonyl)-, propyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.173272904 u |
| Formula |
C13H25NO5 |
| InChI |
InChI=1S/C13H25NO5/c1-5-6-18-12(15)11(9-10(2)3)14-13(16)19-8-7-17-4/h10-11H,5-9H2,1-4H3,(H,14,16) |
| InChIKey |
PZDCBFAVGRJRCR-UHFFFAOYSA-N |
| Molecular Weight |
275.345 g/mol |
| SMILES |
COCCOC(NC(CC(C)C)C(OCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846658 |