| SpectraBase Spectrum ID |
C0Wsqhv5Ka9 |
| Name |
leu-val, N-(Ethoxycarbonyl)-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.199822005 u |
| Formula |
C15H28N2O5 |
| InChI |
InChI=1S/C15H28N2O5/c1-7-22-15(20)16-11(8-9(2)3)13(18)17-12(10(4)5)14(19)21-6/h9-12H,7-8H2,1-6H3,(H,16,20)(H,17,18) |
| InChIKey |
KCELGEIGWFFMLF-UHFFFAOYSA-N |
| Molecular Weight |
316.398 g/mol |
| SMILES |
C(C(CC(C)C)NC(OCC)=O)(=O)NC(C(=O)OC)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857455 |
