| SpectraBase Compound ID | KyhQ51CF0iD |
|---|---|
| InChI | InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h1H,3-5H2,(H,7,8) |
| InChIKey | VPFMEXRVUOPYRG-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 | 9gEfjdtkAeB |
|---|---|
| Name | 5-Hexynoic acid |
| CAS Registry Number | 53293-00-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8O2 |
| InChI | InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h1H,3-5H2,(H,7,8) |
| InChIKey | VPFMEXRVUOPYRG-UHFFFAOYSA-N |
| Molecular Weight | 112.128 g/mol |
| SMILES | OC(CCCC#C)=O |
| SPLASH | splash10-00di-9000000000-b15387ef4c0d6108dd6c |
| Source of Spectrum | J-49-2335-0 |
| Synonyms | 5-Hexyn-1-oic acid Hex-5-ynoic acid |
| Wiley ID | 1123077 |