| SpectraBase Compound ID | 7vilEkvDngl |
|---|---|
| InChI | InChI=1S/C6H8O/c1-3-4-5-6(2)7/h3H2,1-2H3 |
| InChIKey | LTAPKZGQTMVYMX-UHFFFAOYSA-N |
| Mol Weight | 96.13 g/mol |
| Molecular Formula | C6H8O |
| Exact Mass | 96.057515 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IsYVsav9zTk |
|---|---|
| Name | hex-3-yn-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8O |
| InChI | InChI=1S/C6H8O/c1-3-4-5-6(2)7/h3H2,1-2H3 |
| InChIKey | LTAPKZGQTMVYMX-UHFFFAOYSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/cctc.202002011 |
| Molecular Weight | 96.129 g/mol |
| SMILES | C(#CCC)C(C)=O |
| SPLASH | splash10-0f89-9000000000-15280f65a229d3760123 |
| Source of Spectrum | CCC-13-SM23-22 |
| Wiley ID | 1854339 |