| SpectraBase Compound ID | 52426cExNkU |
|---|---|
| InChI | InChI=1S/C7H12O/c1-4-5-7(2,3)6-8/h1,8H,5-6H2,2-3H3 |
| InChIKey | JZQWKSNREHAZIT-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HES269fiQc |
|---|---|
| Name | 2,2-Dimethyl-4-pentyn-1-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-4-5-7(2,3)6-8/h1,8H,5-6H2,2-3H3 |
| InChIKey | JZQWKSNREHAZIT-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | OCC(CC#C)(C)C |
| SPLASH | splash10-0ak9-9000000000-7f08ae0708b04d9e3b16 |
| Source of Spectrum | J-58-1906-23 |
| Synonyms | 2,2-Dimethylpent-4-yn-1-ol |
| Wiley ID | 1123518 |