| SpectraBase Spectrum ID |
6239UjQg4ea |
| Name |
Propanoic acid, 2-((2-[(1,1-dimethylethoxycarbonyl)amino]propanoyl)amino) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.137221747 u |
| Formula |
C11H20N2O5 |
| InChI |
InChI=1S/C11H20N2O5/c1-6(8(14)12-7(2)9(15)16)13-10(17)18-11(3,4)5/h6-7H,1-5H3,(H,12,14)(H,13,17)(H,15,16) |
| InChIKey |
BZNDDHWTEVCBAD-UHFFFAOYSA-N |
| Molecular Weight |
260.290 g/mol |
| SMILES |
C(=O)(NC(C)C(O)=O)C(C)NC(OC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944888 |