| SpectraBase Compound ID | 3668aQSnAXK |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-9(13)15-11(12(2,3)14)10-7-5-4-6-8-10/h4-8,11,14H,1-3H3 |
| InChIKey | WEUYRIKHVZWEHB-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AoGfWb61nPg |
|---|---|
| Name | 2-Hydroxy-2-methyl-1-phenylpropyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.109944372 u |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-9(13)15-11(12(2,3)14)10-7-5-4-6-8-10/h4-8,11,14H,1-3H3 |
| InChIKey | WEUYRIKHVZWEHB-UHFFFAOYSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C(OC(=O)C)(C(O)(C)C)C=1C=CC=CC1 |