| SpectraBase Compound ID | DuODPiD7wEN |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-3-6(8)5-7(9)4-2/h3-5H2,1-2H3 |
| InChIKey | DGCTVLNZTFDPDJ-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6XQeryrNbcI |
|---|---|
| Name | 3,5-Heptanedione |
| CAS Registry Number | 7424-54-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-3-6(8)5-7(9)4-2/h3-5H2,1-2H3 |
| InChIKey | DGCTVLNZTFDPDJ-UHFFFAOYSA-N |
| Molecular Weight | 128.171 g/mol |
| SMILES | CCC(=O)CC(=O)CC |
| SPLASH | splash10-0a4j-9100000000-10c3bd7ed71fa9ff50dd |
| Source of Spectrum | W5-3819-0-0 |
| Synonyms | Dipropionylmethane Heptane-3,5-dione EINECS 231-054-5 |
| Wiley ID | 1131245 |