| SpectraBase Spectrum ID |
FQ20bT155fV |
| Name |
Dimethyl 2-(benzyloxycarbonylamino)-4-hydroxypentane-1,5-dioate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.116151949 u |
| Formula |
C15H19NO7 |
| InChI |
InChI=1S/C15H19NO7/c1-21-13(18)11(8-12(17)14(19)22-2)16-15(20)23-9-10-6-4-3-5-7-10/h3-7,11-12,17H,8-9H2,1-2H3,(H,16,20) |
| InChIKey |
WKGTXWFVXZEFBE-UHFFFAOYSA-N |
| Molecular Weight |
325.317 g/mol |
| SMILES |
C(NC(CC(C(=O)OC)O)C(=O)OC)(=O)OCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969484 |
