| SpectraBase Spectrum ID |
2gxPDEHXnWj |
| Name |
7-Iodo-1-(naphthalen-1-ylmethyl)-1H-indole-2,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.991273628 u |
| Formula |
C19H12INO2 |
| InChI |
InChI=1S/C19H12INO2/c20-16-10-4-9-15-17(16)21(19(23)18(15)22)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2 |
| InChIKey |
OMGYPRBCOVPOJG-UHFFFAOYSA-N |
| Molecular Weight |
413.214 g/mol |
| SMILES |
C1(N(C=2C(=CC=CC2C1=O)I)CC=1C=CC=C2C=CC=CC12)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901986 |
