| SpectraBase Compound ID | JBmVG5GEsqx |
|---|---|
| InChI | InChI=1S/C9H8BrNO/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4H,5-6H2 |
| InChIKey | OHJDDVYUQCSBSG-UHFFFAOYSA-N |
| Mol Weight | 226.07 g/mol |
| Molecular Formula | C9H8BrNO |
| Exact Mass | 224.978927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | d3yVKRQg1f |
|---|---|
| Name | 2-(4-Bromophenyl)-4,5-dihydrooxazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.978926881 u |
| Formula | C9H8BrNO |
| InChI | InChI=1S/C9H8BrNO/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4H,5-6H2 |
| InChIKey | OHJDDVYUQCSBSG-UHFFFAOYSA-N |
| Molecular Weight | 226.073 g/mol |
| SMILES | C1(C=2OCCN2)=CC=C(C=C1)Br |