| SpectraBase Spectrum ID |
4NCy7CGcUzx |
| Name |
7-Bromo-3-(3,3-dimethyl-2-oxobutyl)-1-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 |
427.078306569 u |
| Formula |
C22H22BrNO3 |
| InChI |
InChI=1S/C22H22BrNO3/c1-21(2,3)18(26)12-15-19(14-8-6-5-7-9-14)22(24(4)20(15)27)11-10-17(25)16(23)13-22/h5-11,13H,12H2,1-4H3 |
| InChIKey |
KWMIIIBBTONIGH-UHFFFAOYSA-N |
| Molecular Weight |
428.326 g/mol |
| SMILES |
C1(N(C2(C(=C1CC(C(C)(C)C)=O)C1=CC=CC=C1)C=CC(C(=C2)Br)=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928435 |
![7-Bromo-3-(3,3-dimethyl-2-oxobutyl)-1-methyl-4-phenyl-1-azaspiro[4.5]deca-3,6,9-triene-2,8-dione](/api/spectrum/4NCy7CGcUzx/structure.png?h=300&w=458 "7-Bromo-3-(3,3-dimethyl-2-oxobutyl)-1-methyl-4-phenyl-1-azaspiro[4.5]deca-3,6,9-triene-2,8-dione")
