| SpectraBase Spectrum ID |
ECNmR4IeeqV |
| Name |
1H-Isoindole-1,3(2H)-dione, 2-[3-(3,4-dihydro-2-methyl-1(2H)-quinolinyl)propyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.168127954 u |
| Formula |
C21H22N2O2 |
| InChI |
InChI=1S/C21H22N2O2/c1-15-11-12-16-7-2-5-10-19(16)22(15)13-6-14-23-20(24)17-8-3-4-9-18(17)21(23)25/h2-5,7-10,15H,6,11-14H2,1H3 |
| InChIKey |
AZADVMLMVPOMPL-UHFFFAOYSA-N |
| Molecular Weight |
334.419 g/mol |
| SMILES |
CC1CCC=2C(N1CCCN1C(=O)C3=CC=CC=C3C1=O)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930314 |