| SpectraBase Spectrum ID |
ANGhzjhz8SJ |
| Name |
2-Benzoyl-6-phenyl-4,4a,5,7,7a,8-hexahydropyrazolo[4,5-e]isoindole-5,7-dione |
| Alternate Name(s) |
1-Methyl-7-phenyl-5,5a,8a,8b-tetrahydro-4H-pyrrolo[3,4-e]indazole-6,8-dione |
| Comments |
Note: The molecular formula of the structure shown is C22H16N3O3 - which differs from the formula reported for the mass spectrum (C22H17N3O3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H17N3O3 |
| InChI |
InChI=1S/C22H16N3O3/c26-19-11-18-16(12-24(23-18)22(27)15-9-5-2-6-10-15)17-13-25(28)21(20(17)19)14-7-3-1-4-8-14/h1-10,12,17H,11,13H2 |
| InChIKey |
QQKRSUIOMNUIFW-UHFFFAOYSA-N |
| Molecular Weight |
370.388 g/mol |
| SMILES |
C=1([N](CC2c3c(CC(C12)=O)n[n](c3)C(c1ccccc1)=O)=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-3901000000-094cdc87790b8492f3c8 |
| Source of Spectrum |
F-48-8114-34 |
| Wiley ID |
1355047 |
![2-Benzoyl-6-phenyl-4,4a,5,7,7a,8-hexahydropyrazolo[4,5-e]isoindole-5,7-dione](/api/spectrum/ANGhzjhz8SJ/structure.png?h=300&w=458 "2-Benzoyl-6-phenyl-4,4a,5,7,7a,8-hexahydropyrazolo[4,5-e]isoindole-5,7-dione")
