| SpectraBase Compound ID | AIWQlulCOHP |
|---|---|
| InChI | InChI=1S/C8H5Br/c1-2-7-4-3-5-8(9)6-7/h1,3-6H |
| InChIKey | TZDXNFAAJNEYIO-UHFFFAOYSA-N |
| Mol Weight | 181.03 g/mol |
| Molecular Formula | C8H5Br |
| Exact Mass | 179.957463 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GQUJqLiimnD |
|---|---|
| Name | 3-Bromophenylacetylene |
| CAS Registry Number | 766-81-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5Br |
| InChI | InChI=1S/C8H5Br/c1-2-7-4-3-5-8(9)6-7/h1,3-6H |
| InChIKey | TZDXNFAAJNEYIO-UHFFFAOYSA-N |
| Molecular Weight | 181.032 g/mol |
| SMILES | C(#C)c1cc(Br)ccc1 |
| SPLASH | splash10-0f89-3900000000-178a26d5182c9112e3a9 |
| Source of Spectrum | K-125-919-0 |
| Synonyms | 1-Bromanyl-3-ethynyl-benzene 1-Bromo-3-ethynyl-benzene |
| Wiley ID | 1175811 |