| SpectraBase Compound ID | 4ArUviLBUw3 |
|---|---|
| InChI | InChI=1S/C6H8O2/c1-5(2)3-4-6(7)8/h5H,1-2H3,(H,7,8) |
| InChIKey | RQIRASYNLSFTIG-UHFFFAOYSA-N |
| Mol Weight | 112.13 g/mol |
| Molecular Formula | C6H8O2 |
| Exact Mass | 112.052429 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 76u6lkxNM7h |
|---|---|
| Name | 4-Methylpent-2-ynoic acid |
| Alternate Name(s) | 4-Methyl-2-pentynoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8O2 |
| InChI | InChI=1S/C6H8O2/c1-5(2)3-4-6(7)8/h5H,1-2H3,(H,7,8) |
| InChIKey | RQIRASYNLSFTIG-UHFFFAOYSA-N |
| Molecular Weight | 112.128 g/mol |
| SMILES | OC(C#CC(C)C)=O |
| SPLASH | splash10-02ta-9300000000-32ba2af4214163fa7a21 |
| Source of Spectrum | F5-2-1509-9b |
| Wiley ID | 1731864 |