| SpectraBase Compound ID | v7N5e41hJJ |
|---|---|
| InChI | InChI=1S/C15H20O3/c1-11(16)5-6-12-7-9-13(10-8-12)18-14(17)15(2,3)4/h7-10H,5-6H2,1-4H3 |
| InChIKey | IFBSPBWKBCYKAM-UHFFFAOYSA-N |
| Mol Weight | 248.32 g/mol |
| Molecular Formula | C15H20O3 |
| Exact Mass | 248.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4OEl40WMjWQ |
|---|---|
| Name | 4-(4-Hydroxyphenyl)-2-butanone, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.141244501 u |
| Formula | C15H20O3 |
| InChI | InChI=1S/C15H20O3/c1-11(16)5-6-12-7-9-13(10-8-12)18-14(17)15(2,3)4/h7-10H,5-6H2,1-4H3 |
| InChIKey | IFBSPBWKBCYKAM-UHFFFAOYSA-N |
| Molecular Weight | 248.322 g/mol |
| SMILES | C(CC(C)=O)C1=CC=C(C=C1)OC(C(C)(C)C)=O |