| SpectraBase Compound ID | 8TukDbCgE8j |
|---|---|
| InChI | InChI=1S/C13H11BrO3/c1-3-4-11(13(16)17-2)12(15)9-5-7-10(14)8-6-9/h1,5-8,11H,4H2,2H3 |
| InChIKey | GPXIDWASEBAPSN-UHFFFAOYSA-N |
| Mol Weight | 295.13 g/mol |
| Molecular Formula | C13H11BrO3 |
| Exact Mass | 293.989157 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1Ki2DCvLYbt |
|---|---|
| Name | Methyl 2-(4-bromobenzoyl)pent-4-ynoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H11BrO3 |
| InChI | InChI=1S/C13H11BrO3/c1-3-4-11(13(16)17-2)12(15)9-5-7-10(14)8-6-9/h1,5-8,11H,4H2,2H3 |
| InChIKey | GPXIDWASEBAPSN-UHFFFAOYSA-N |
| Molecular Weight | 295.132 g/mol |
| SMILES | COC(=O)C(CC#C)C(=O)c1ccc(cc1)Br |
| SPLASH | splash10-001i-0900000000-69a309e666ecba17182f |
| Source of Spectrum | ASC-352-1163/SM4-2h |
| Wiley ID | 1764428 |