| SpectraBase Spectrum ID |
AjO7M7LnxrW |
| Name |
3-Bromo-1-(2-iodobenzyl)-6-methyl-4-phenyl-1-azaspiro-[4.5]deca-3,6,9-triene-2,8-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
544.948736789 u |
| Formula |
C23H17BrINO2 |
| InChI |
InChI=1S/C23H17BrINO2/c1-15-13-18(27)11-12-23(15)20(16-7-3-2-4-8-16)21(24)22(28)26(23)14-17-9-5-6-10-19(17)25/h2-13H,14H2,1H3 |
| InChIKey |
YKCSNSCBAOIZFN-UHFFFAOYSA-N |
| Molecular Weight |
546.202 g/mol |
| SMILES |
C12(C(=CC(C=C2)=O)C)N(C(C(=C1C1=CC=CC=C1)Br)=O)CC1=CC=CC=C1I |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844113 |
![3-Bromo-1-(2-iodobenzyl)-6-methyl-4-phenyl-1-azaspiro-[4.5]deca-3,6,9-triene-2,8-dione](/api/spectrum/AjO7M7LnxrW/structure.png?h=300&w=458 "3-Bromo-1-(2-iodobenzyl)-6-methyl-4-phenyl-1-azaspiro-[4.5]deca-3,6,9-triene-2,8-dione")
