![2-Bromo-8-azabicyclo[4.3.0]non-3-en-7,9-dione](/api/spectrum/7KvsHpD130J/structure.png?h=300&w=458 "2-Bromo-8-azabicyclo[4.3.0]non-3-en-7,9-dione")
| SpectraBase Compound ID | Eou0yBtv72O |
|---|---|
| InChI | InChI=1S/C8H8BrNO2/c9-5-3-1-2-4-6(5)8(12)10-7(4)11/h1,3-6H,2H2,(H,10,11,12)/t4-,5-,6-/m1/s1 |
| InChIKey | OPLGDBDUPIFGPU-HSUXUTPPSA-N |
| Mol Weight | 230.06 g/mol |
| Molecular Formula | C8H8BrNO2 |
| Exact Mass | 228.973841 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7KvsHpD130J |
|---|---|
| Name | 2-Bromo-8-azabicyclo[4.3.0]non-3-en-7,9-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8BrNO2 |
| InChI | InChI=1S/C8H8BrNO2/c9-5-3-1-2-4-6(5)8(12)10-7(4)11/h1,3-6H,2H2,(H,10,11,12)/t4-,5-,6-/m1/s1 |
| InChIKey | OPLGDBDUPIFGPU-HSUXUTPPSA-N |
| Molecular Weight | 230.061 g/mol |
| SMILES | N1C([C@]2([C@@](C1=O)([C@@](C=CC2)(Br)[H])[H])[H])=O |
| SPLASH | splash10-0kdi-6900000000-8b8649980b61cff71d86 |
| Source of Spectrum | KC-0-364-11 |
| Synonyms | (3aS,4R,7aR)-4-Bromo-3a,4,7,7a-tetrahydro-isoindole-1,3-dione 4-Bromo-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione (3aS,4R,7aR)-4-bromo-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aS,4R,7aR)-4-bromanyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione |
| Wiley ID | 820457 |