| SpectraBase Spectrum ID |
BfRmPdr6QSL |
| Name |
2-[2-(Benzyloxy)ethyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.120843408 u |
| Formula |
C21H17NO3 |
| InChI |
InChI=1S/C21H17NO3/c23-20-17-10-4-8-16-9-5-11-18(19(16)17)21(24)22(20)12-13-25-14-15-6-2-1-3-7-15/h1-11H,12-14H2 |
| InChIKey |
CQAXZOWZXLYASA-UHFFFAOYSA-N |
| Molecular Weight |
331.371 g/mol |
| SMILES |
C=1C=CC(COCCN2C(C=3C=CC=C4C3C(C2=O)=CC=C4)=O)=CC1 |