| SpectraBase Spectrum ID |
Aea8uEhVp48 |
| Name |
5-(Benzyloxy)-2-[methyl(pyridin-2-yl)amino]isoindoline-1,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.126991416 u |
| Formula |
C21H17N3O3 |
| InChI |
InChI=1S/C21H17N3O3/c1-23(19-9-5-6-12-22-19)24-20(25)17-11-10-16(13-18(17)21(24)26)27-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3 |
| InChIKey |
DFSGVOYVZCALFR-UHFFFAOYSA-N |
| Molecular Weight |
359.385 g/mol |
| SMILES |
C1=CC2=C(C=C1OCC1=CC=CC=C1)C(N(C2=O)N(C)C1=NC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895204 |
![5-(Benzyloxy)-2-[methyl(pyridin-2-yl)amino]isoindoline-1,3-dione](/api/spectrum/Aea8uEhVp48/structure.png?h=300&w=458 "5-(Benzyloxy)-2-[methyl(pyridin-2-yl)amino]isoindoline-1,3-dione")
