| SpectraBase Spectrum ID |
Jge1AHDYG3S |
| Name |
N-(2,3,3A,4,7,7A-Hexahydro-2,6-dimethyl-1,3-dioxo-1H-isoindol-4-yl)-3-phenylpropiolamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.131742445 u |
| Formula |
C19H18N2O3 |
| InChI |
InChI=1S/C19H18N2O3/c1-12-10-14-17(19(24)21(2)18(14)23)15(11-12)20-16(22)9-8-13-6-4-3-5-7-13/h3-7,11,14-15,17H,10H2,1-2H3,(H,20,22) |
| InChIKey |
LWJILPZBHPJAAY-UHFFFAOYSA-N |
| Molecular Weight |
322.364 g/mol |
| SMILES |
C(C#CC=1C=CC=CC1)(=O)NC1C2C(N(C(C2CC(=C1)C)=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97923 |
