| SpectraBase Spectrum ID |
F04ZTFh5EfK |
| Name |
2-(p-Anisoylamino)malonic acid diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.121237330 u |
| Formula |
C15H19NO6 |
| InChI |
InChI=1S/C15H19NO6/c1-4-21-14(18)12(15(19)22-5-2)16-13(17)10-6-8-11(20-3)9-7-10/h6-9,12H,4-5H2,1-3H3,(H,16,17) |
| InChIKey |
XDBUQKNZNHQKFA-UHFFFAOYSA-N |
| Molecular Weight |
309.318 g/mol |
| SMILES |
C(C(C(=O)OCC)NC(C=1C=CC(=CC1)OC)=O)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895182 |
