| SpectraBase Compound ID | DJCTZBPEajK |
|---|---|
| InChI | InChI=1S/C9H14O/c1-5-6-9(3,4)7-8(2)10/h1H,6-7H2,2-4H3 |
| InChIKey | PXIVGHUHGWWZJQ-UHFFFAOYSA-N |
| Mol Weight | 138.21 g/mol |
| Molecular Formula | C9H14O |
| Exact Mass | 138.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LgOoReaAgwJ |
|---|---|
| Name | 6-Heptyn-2-one, 4,4-dimethyl- |
| CAS Registry Number | 17520-15-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H14O |
| InChI | InChI=1S/C9H14O/c1-5-6-9(3,4)7-8(2)10/h1H,6-7H2,2-4H3 |
| InChIKey | PXIVGHUHGWWZJQ-UHFFFAOYSA-N |
| Molecular Weight | 138.210 g/mol |
| SMILES | CC(CC#C)(C)CC(=O)C |
| SPLASH | splash10-0006-9000000000-535d4af97796a2ec8741 |
| Synonyms | 4,4-Dimethyl-6-heptyn-2-one 4,4-Dimethylhept-6-yn-2-one |
| Wiley ID | 1485920 |