| SpectraBase Spectrum ID |
1abl8Ps0Sbh |
| Name |
Methoxycarbonylaminophenyl-acetic-acid-methylester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
223.084457899 u |
| Formula |
C11H13NO4 |
| InChI |
InChI=1S/C11H13NO4/c1-15-10(13)9(12-11(14)16-2)8-6-4-3-5-7-8/h3-7,9H,1-2H3,(H,12,14) |
| InChIKey |
KUDRZXYHQUCFTN-UHFFFAOYSA-N |
| Molecular Weight |
223.228 g/mol |
| SMILES |
C(=O)(C(C1=CC=CC=C1)NC(=O)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.984367 |