SpectraBase Spectrum ID |
2qx0bGgyIge |
Name |
N-(2,6-Dimethylphenyl)-2-(2,3-dioxoindolin-1-yl)-3-methylbutanamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.163042573 u |
Formula |
C21H22N2O3 |
InChI |
InChI=1S/C21H22N2O3/c1-12(2)18(20(25)22-17-13(3)8-7-9-14(17)4)23-16-11-6-5-10-15(16)19(24)21(23)26/h5-12,18H,1-4H3,(H,22,25) |
InChIKey |
PZXRDNYUXNZTQY-UHFFFAOYSA-N |
Molecular Weight |
350.418 g/mol |
SMILES |
C(C(C(C)C)N1C(C(C2=C1C=CC=C2)=O)=O)(=O)NC1=C(C=CC=C1C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919508 |