| SpectraBase Compound ID | 3WjS40KTQKo |
|---|---|
| InChI | InChI=1S/C8H6BrN/c1-6-3-2-4-7(5-10)8(6)9/h2-4H,1H3 |
| InChIKey | RNHZLKDKPMISMY-UHFFFAOYSA-N |
| Mol Weight | 196.05 g/mol |
| Molecular Formula | C8H6BrN |
| Exact Mass | 194.968362 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | vjSSCykEKo |
|---|---|
| Name | 2-Bromo-3-methyl-benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6BrN |
| InChI | InChI=1S/C8H6BrN/c1-6-3-2-4-7(5-10)8(6)9/h2-4H,1H3 |
| InChIKey | RNHZLKDKPMISMY-UHFFFAOYSA-N |
| Molecular Weight | 196.047 g/mol |
| SMILES | C(#N)c1c(c(C)ccc1)Br |
| SPLASH | splash10-014i-1900000000-97fbd22818108cce3464 |
| Source of Spectrum | H-83-89-7 |
| Synonyms | 2-Bromo-3-methylbenzonitrile |
| Wiley ID | 846983 |