| SpectraBase Spectrum ID |
EvYUDhyN1T2 |
| Name |
3-me-4-ma N-(4-Ethylbenzoyl) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.188529047 u |
| Formula |
C20H25NO2 |
| InChI |
InChI=1S/C20H25NO2/c1-5-16-6-9-18(10-7-16)20(22)21-15(3)13-17-8-11-19(23-4)14(2)12-17/h6-12,15H,5,13H2,1-4H3,(H,21,22) |
| InChIKey |
UVAGUFFYIBJNPW-UHFFFAOYSA-N |
| Molecular Weight |
311.425 g/mol |
| SMILES |
C(C=1C=CC(=CC1)CC)(NC(CC1=CC(=C(C=C1)OC)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828062 |
