| SpectraBase Compound ID | VwUHAs0KNF |
|---|---|
| InChI | InChI=1S/C10H14O3/c1-3-4-5-9-10(12)8(11)6-7(2)13-9/h6,12H,3-5H2,1-2H3 |
| InChIKey | XVPDSJFMTVIDAG-UHFFFAOYSA-N |
| Mol Weight | 182.22 g/mol |
| Molecular Formula | C10H14O3 |
| Exact Mass | 182.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JV9ZGfRscVj |
|---|---|
| Name | 2-Butyl-3-hydroxy-6-methyl-4-pyranone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.094294308 u |
| Formula | C10H14O3 |
| InChI | InChI=1S/C10H14O3/c1-3-4-5-9-10(12)8(11)6-7(2)13-9/h6,12H,3-5H2,1-2H3 |
| InChIKey | XVPDSJFMTVIDAG-UHFFFAOYSA-N |
| Molecular Weight | 182.219 g/mol |
| SMILES | C1(=C(OC(=CC1=O)C)CCCC)O |