| SpectraBase Compound ID | EOcOGS0GLaB |
|---|---|
| InChI | InChI=1S/C20H11Br2NO2/c21-13-4-6-16-17-7-5-14(22)11-20(17)18(19(16)10-13)9-12-2-1-3-15(8-12)23(24)25/h1-11H |
| InChIKey | FRIFJDHIPOCWTC-UHFFFAOYSA-N |
| Mol Weight | 457.12 g/mol |
| Molecular Formula | C20H11Br2NO2 |
| Exact Mass | 454.915655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BjNWhcstSy4 |
|---|---|
| Name | 2,7-Dibromo-9-(m-nitrobenzylidene)fluorene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 454.915654596 u |
| Formula | C20H11Br2NO2 |
| InChI | InChI=1S/C20H11Br2NO2/c21-13-4-6-16-17-7-5-14(22)11-20(17)18(19(16)10-13)9-12-2-1-3-15(8-12)23(24)25/h1-11H |
| InChIKey | FRIFJDHIPOCWTC-UHFFFAOYSA-N |
| Molecular Weight | 457.121 g/mol |
| SMILES | N(=O)(=O)C=1C=C(C=CC1)C=C1C=2C=C(C=CC2C=2C=CC(=CC12)Br)Br |