| SpectraBase Spectrum ID |
IpJbfKSuXt8 |
| Name |
N-Ethoxycarbonyl-N-(4-ethoxycarbonyloxyphenyl)glycine, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.131802013 u |
| Formula |
C16H21NO7 |
| InChI |
InChI=1S/C16H21NO7/c1-4-21-14(18)11-17(15(19)22-5-2)12-7-9-13(10-8-12)24-16(20)23-6-3/h7-10H,4-6,11H2,1-3H3 |
| InChIKey |
CLDUVDHEPXKNBB-UHFFFAOYSA-N |
| Molecular Weight |
339.344 g/mol |
| SMILES |
C1=CC(=CC=C1N(CC(OCC)=O)C(OCC)=O)OC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974046 |
