| SpectraBase Spectrum ID |
IKkaX0CexHu |
| Name |
Terephthalic acid, monoamide, N-(2-methoxyphenyl)-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
299.115758027 u |
| Formula |
C17H17NO4 |
| InChI |
InChI=1S/C17H17NO4/c1-3-22-17(20)13-10-8-12(9-11-13)16(19)18-14-6-4-5-7-15(14)21-2/h4-11H,3H2,1-2H3,(H,18,19) |
| InChIKey |
ZGOMCGVIAUNWPO-UHFFFAOYSA-N |
| SMILES |
CCOC(=O)C1=CC=C(C=C1)C(=O)NC1=C(OC)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932124 |
