| SpectraBase Compound ID | B6PT1kwEB1O |
|---|---|
| InChI | InChI=1S/C6H10O/c1-3-5-6(7)4-2/h3H,1,4-5H2,2H3 |
| InChIKey | RUJLJMUWUVTHEU-UHFFFAOYSA-N |
| Mol Weight | 98.14 g/mol |
| Molecular Formula | C6H10O |
| Exact Mass | 98.073165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IeeWWFCrqw2 |
|---|---|
| Name | 5-Hexen-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 98.073164941 u |
| Formula | C6H10O |
| InChI | InChI=1S/C6H10O/c1-3-5-6(7)4-2/h3H,1,4-5H2,2H3 |
| InChIKey | RUJLJMUWUVTHEU-UHFFFAOYSA-N |
| Molecular Weight | 98.145 g/mol |
| SMILES | C(C(CC)=O)C=C |