| SpectraBase Spectrum ID |
9cHz2okxvFq |
| Name |
N-(2,3,3A,4,7,7A-Hexahydro-2,4-dimethyl-1,3-dioxo-1H-isoindol-7-yl)-N-methyl-3-phenylpropiolamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.147392509 u |
| Formula |
C20H20N2O3 |
| InChI |
InChI=1S/C20H20N2O3/c1-13-9-11-15(18-17(13)19(24)22(3)20(18)25)21(2)16(23)12-10-14-7-5-4-6-8-14/h4-9,11,13,15,17-18H,1-3H3 |
| InChIKey |
UGGVGPFUSNQDOX-UHFFFAOYSA-N |
| Molecular Weight |
336.391 g/mol |
| SMILES |
C(C#CC=1C=CC=CC1)(=O)N(C)C1C=CC(C2C(N(C(C12)=O)C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.820103 |
