| SpectraBase Compound ID | LbsaX8To9QE |
|---|---|
| InChI | InChI=1S/C6H8O/c1-3-4-5-6(2)7/h4H,1,5H2,2H3 |
| InChIKey | OXTPWHNQBSBPDM-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 | 4zgseatXnkw |
|---|---|
| Name | 4,5-Hexadien-2-one |
| CAS Registry Number | 35504-50-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8O |
| InChI | InChI=1S/C6H8O/c1-3-4-5-6(2)7/h4H,1,5H2,2H3 |
| InChIKey | OXTPWHNQBSBPDM-UHFFFAOYSA-N |
| Molecular Weight | 96.129 g/mol |
| SMILES | C(=C=C)CC(=O)C |
| SPLASH | splash10-0006-9000000000-a19762507e7937e47656 |
| Source of Spectrum | H-60-3055-0 |
| Wiley ID | 1118146 |