| SpectraBase Spectrum ID |
6a6AZxRLWNn |
| Name |
Terephthalic acid, monoamide, N-(2-methoxyphenyl)-, pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.162708221 u |
| Formula |
C20H23NO4 |
| InChI |
InChI=1S/C20H23NO4/c1-3-4-7-14-25-20(23)16-12-10-15(11-13-16)19(22)21-17-8-5-6-9-18(17)24-2/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,21,22) |
| InChIKey |
VYPKJRDLKPYFBQ-UHFFFAOYSA-N |
| Molecular Weight |
341.407 g/mol |
| SMILES |
C(COC(=O)C1=CC=C(C=C1)C(=O)NC1=CC=CC=C1OC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858738 |
