| SpectraBase Spectrum ID |
KadTmsyxXCp |
| Name |
Ethylglycyl-ethylglycine, N-isopropyloxycarbonyl-, methyl ester (isomer 1) |
| 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/c1-6-9(15-13(18)20-8(3)4)11(16)14-10(7-2)12(17)19-5/h8-10H,6-7H2,1-5H3,(H,14,16)(H,15,18) |
| InChIKey |
VZSWBZQTRAIVDF-UHFFFAOYSA-N |
| SMILES |
C(C(C(NC(CC)C(OC)=O)=O)NC(OC(C)C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860014 |
