| SpectraBase Compound ID | 7tTW2wpBWN1 |
|---|---|
| InChI | InChI=1S/C9H7Br/c1-3-8-5-4-7(2)6-9(8)10/h1,4-6H,2H3 |
| InChIKey | UESKTOOBVQXNFQ-UHFFFAOYSA-N |
| Mol Weight | 195.06 g/mol |
| Molecular Formula | C9H7Br |
| Exact Mass | 193.973113 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8rnZuyOMyo3 |
|---|---|
| Name | 2-Bromo-1-ethynyl-4-methylbenzene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7Br |
| InChI | InChI=1S/C9H7Br/c1-3-8-5-4-7(2)6-9(8)10/h1,4-6H,2H3 |
| InChIKey | UESKTOOBVQXNFQ-UHFFFAOYSA-N |
| Molecular Weight | 195.059 g/mol |
| SMILES | C(#C)c1c(cc(cc1)C)Br |
| SPLASH | splash10-014m-0900000000-b971ab8be5a091b8be07 |
| Source of Spectrum | QE-15-2658-15 |
| Wiley ID | 1692740 |