| SpectraBase Compound ID | J41VGtTWdh |
|---|---|
| InChI | InChI=1S/C15H22O2/c1-4-8-14(12(3)16)15(17)11(2)13-9-6-5-7-10-13/h5-7,9-11,14-15,17H,4,8H2,1-3H3 |
| InChIKey | UWVXQOMKRZRYRW-UHFFFAOYSA-N |
| Mol Weight | 234.34 g/mol |
| Molecular Formula | C15H22O2 |
| Exact Mass | 234.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4DRii3jnNXV |
|---|---|
| Name | 2-Hexanone, 3-ethyl-4-hydroxy-5-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.161979946 u |
| Formula | C15H22O2 |
| InChI | InChI=1S/C15H22O2/c1-4-8-14(12(3)16)15(17)11(2)13-9-6-5-7-10-13/h5-7,9-11,14-15,17H,4,8H2,1-3H3 |
| InChIKey | UWVXQOMKRZRYRW-UHFFFAOYSA-N |
| Molecular Weight | 234.339 g/mol |
| SMILES | OC(C(C(C)=O)CCC)C(C)c1ccccc1 |