| SpectraBase Compound ID | Id6bkzGb8ig |
|---|---|
| InChI | InChI=1S/C7H4BrN/c8-7-3-1-6(5-9)2-4-7/h1-4H |
| InChIKey | HQSCPPCMBMFJJN-UHFFFAOYSA-N |
| Mol Weight | 182.02 g/mol |
| Molecular Formula | C7H4BrN |
| Exact Mass | 180.952712 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B0oAb7XsUNs |
|---|---|
| Name | 4-Bromobenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4BrN |
| InChI | InChI=1S/C7H4BrN/c8-7-3-1-6(5-9)2-4-7/h1-4H |
| InChIKey | HQSCPPCMBMFJJN-UHFFFAOYSA-N |
| Instrument Name | Agilent 6890-5973N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/asia.202100776 |
| Molecular Weight | 182.020 g/mol |
| SMILES | c1(Br)ccc(cc1)C#N |
| SPLASH | splash10-0ue9-4900000000-d22c4f6b7c8a7fb9918c |
| Source of Spectrum | CAJ-16-SM15-15-1 |
| Wiley ID | 1866983 |