| SpectraBase Spectrum ID |
5futQhVf3JB |
| Name |
2-(2-Phthalimidopropyl)isoindoline-1,3-quinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.095356935 u |
| Formula |
C19H14N2O4 |
| InChI |
InChI=1S/C19H14N2O4/c1-11(21-18(24)14-8-4-5-9-15(14)19(21)25)10-20-16(22)12-6-2-3-7-13(12)17(20)23/h2-9,11H,10H2,1H3 |
| InChIKey |
NKRIVWOGWTVIAH-UHFFFAOYSA-N |
| Molecular Weight |
334.331 g/mol |
| SMILES |
C1(N(C(C2=CC=CC=C12)=O)CC(N1C(C2=CC=CC=C2C1=O)=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877737 |
