| SpectraBase Spectrum ID |
EQuEbEPTNvD |
| Name |
Glutaric acid, monoamide, N-(4-ethylphenyl)-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.152143537 u |
| Formula |
C15H21NO3 |
| InChI |
InChI=1S/C15H21NO3/c1-3-12-8-10-13(11-9-12)16-14(17)6-5-7-15(18)19-4-2/h8-11H,3-7H2,1-2H3,(H,16,17) |
| InChIKey |
CAYFWSOQODAHNN-UHFFFAOYSA-N |
| Molecular Weight |
263.337 g/mol |
| SMILES |
CCC1=CC=C(NC(CCCC(OCC)=O)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938673 |
