| SpectraBase Compound ID | FjvBHQ8q4mR |
|---|---|
| InChI | InChI=1S/C13H14O/c1-13(2,3)10-9-12(14)11-7-5-4-6-8-11/h4-8H,1-3H3 |
| InChIKey | JKMPVFBNTHUBPK-UHFFFAOYSA-N |
| Mol Weight | 186.25 g/mol |
| Molecular Formula | C13H14O |
| Exact Mass | 186.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BBT3IsAlppp |
|---|---|
| Name | 4,4-Dimethyl-1-phenylpent-2-yn-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14O |
| InChI | InChI=1S/C13H14O/c1-13(2,3)10-9-12(14)11-7-5-4-6-8-11/h4-8H,1-3H3 |
| InChIKey | JKMPVFBNTHUBPK-UHFFFAOYSA-N |
| Molecular Weight | 186.254 g/mol |
| SMILES | C(C#CC(C)(C)C)(=O)c1ccccc1 |
| SPLASH | splash10-0a4i-1900000000-32d42a236c2c63c50174 |
| Source of Spectrum | K-2001-739-4 |
| Synonyms | 4,4-Dimethyl-1-phenyl-2-pentyn-1-one |
| Wiley ID | 1578753 |