| SpectraBase Compound ID | 4YmrzXhCYq3 |
|---|---|
| InChI | InChI=1S/C7H10O2/c1-4-7(2,3)5-6(8)9/h1H,5H2,2-3H3,(H,8,9) |
| InChIKey | AWFYYVPNFSJVGU-UHFFFAOYSA-N |
| Mol Weight | 126.15 g/mol |
| Molecular Formula | C7H10O2 |
| Exact Mass | 126.06808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D47x93YppkY |
|---|---|
| Name | 3,3-Dimethyl-4-pentynoic Acid |
| CAS Registry Number | 67099-40-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O2 |
| InChI | InChI=1S/C7H10O2/c1-4-7(2,3)5-6(8)9/h1H,5H2,2-3H3,(H,8,9) |
| InChIKey | AWFYYVPNFSJVGU-UHFFFAOYSA-N |
| Molecular Weight | 126.155 g/mol |
| SMILES | OC(CC(C)(C#C)C)=O |
| SPLASH | splash10-02t9-9400000000-d47c6c73dd817209cf45 |
| Source of Spectrum | C-114-7695-10 |
| Synonyms | 3,3-Dimethylpent-4-ynoic acid |
| Wiley ID | 1129965 |