| SpectraBase Compound ID | KzyRhejFP7P |
|---|---|
| InChI | InChI=1S/C6H8O2/c1-4-6(2,3)5(7)8/h1H,2-3H3,(H,7,8) |
| InChIKey | WCDPCILUMOPENA-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 | 4dyWB45KUGe |
|---|---|
| Name | 2,2-Dimethyl-3-butynoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8O2 |
| InChI | InChI=1S/C6H8O2/c1-4-6(2,3)5(7)8/h1H,2-3H3,(H,7,8) |
| InChIKey | WCDPCILUMOPENA-UHFFFAOYSA-N |
| Molecular Weight | 112.128 g/mol |
| SMILES | OC(C(C#C)(C)C)=O |
| SPLASH | splash10-014i-9000000000-7f950fda9e190444c45b |
| Source of Spectrum | C-119-3805-5 |
| Synonyms | 2,2-Dimethylbut-3-ynoic acid |
| Wiley ID | 760379 |