SpectraBase Spectrum ID |
CJzDPNf48Gf |
Name |
L-Leucylglycine, N-ethoxycarbonyl-, ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
288.168521876 u |
Formula |
C13H24N2O5 |
InChI |
InChI=1S/C13H24N2O5/c1-5-19-11(16)8-14-12(17)10(7-9(3)4)15-13(18)20-6-2/h9-10H,5-8H2,1-4H3,(H,14,17)(H,15,18) |
InChIKey |
AQHVBJGKSUVMKH-UHFFFAOYSA-N |
SMILES |
CCOC(NC(CC(C)C)C(NCC(OCC)=O)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873959 |