| SpectraBase Spectrum ID |
OkaFJF8HAd |
| Name |
o-Benzyl-N-carbobenzyloxy-aspartylglycine ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
442.174001178 u |
| Formula |
C23H26N2O7 |
| InChI |
InChI=1S/C23H26N2O7/c1-2-30-21(27)14-24-22(28)19(13-20(26)31-15-17-9-5-3-6-10-17)25-23(29)32-16-18-11-7-4-8-12-18/h3-12,19H,2,13-16H2,1H3,(H,24,28)(H,25,29) |
| InChIKey |
WKYHSGUIFBAQQB-UHFFFAOYSA-N |
| Molecular Weight |
442.468 g/mol |
| SMILES |
C1=C(C=CC=C1)COC(CC(C(NCC(OCC)=O)=O)NC(OCC1=CC=CC=C1)=O)=O |
