| SpectraBase Compound ID | 4ntPkO4zrJh |
|---|---|
| InChI | InChI=1S/C9H8BrN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H,1-2H2 |
| InChIKey | QAWLKTDBUQOFEF-UHFFFAOYSA-N |
| Mol Weight | 210.07 g/mol |
| Molecular Formula | C9H8BrN |
| Exact Mass | 208.984012 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AZ68e0X6HTk |
|---|---|
| Name | 3-(4-Bromophenyl)propanenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8BrN |
| InChI | InChI=1S/C9H8BrN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H,1-2H2 |
| InChIKey | QAWLKTDBUQOFEF-UHFFFAOYSA-N |
| Molecular Weight | 210.074 g/mol |
| SMILES | C(CCc1ccc(cc1)Br)#N |
| SPLASH | splash10-00r2-0910000000-b18e20e46c55479d08a1 |
| Source of Spectrum | J-62-8575-8 |
| Synonyms | 3-(4-Bromophenyl)propionitrile |
| Wiley ID | 1207905 |