| SpectraBase Compound ID | 2rzVtOAo9WW |
|---|---|
| InChI | InChI=1S/C9H13BrO3/c1-6(11)9(7(2)12)4-3-8(13)5-10/h9H,3-5H2,1-2H3 |
| InChIKey | AHHAURVPDGJJRP-UHFFFAOYSA-N |
| Mol Weight | 249.1 g/mol |
| Molecular Formula | C9H13BrO3 |
| Exact Mass | 248.004807 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3Jhlbw8qpWd |
|---|---|
| Name | 5-Acetyl-1-bromo-heptane-2,6-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H13BrO3 |
| InChI | InChI=1S/C9H13BrO3/c1-6(11)9(7(2)12)4-3-8(13)5-10/h9H,3-5H2,1-2H3 |
| InChIKey | AHHAURVPDGJJRP-UHFFFAOYSA-N |
| Molecular Weight | 249.104 g/mol |
| SMILES | C(C(CCC(C(C)=O)C(=O)C)=O)Br |
| SPLASH | splash10-054o-9700000000-9ff578aed3fddd7dcc00 |
| Source of Spectrum | KC-57-5883-6 |
| Synonyms | 5-Acetyl-1-bromo-2,6-heptanedione |
| Wiley ID | 1625038 |