| SpectraBase Compound ID | DpG248uVbs |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-3-15-12(14)8-11(13)10-6-4-9(2)5-7-10/h4-7,11,13H,3,8H2,1-2H3/t11-/m1/s1 |
| InChIKey | YGCZMODLNTWXLW-LLVKDONJSA-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 | CHeBrnza8YM |
|---|---|
| Name | (3R)-Ethyl .beta.-hydroxy-.beta.-(p-methylphenyl)propionate |
| 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/c1-3-15-12(14)8-11(13)10-6-4-9(2)5-7-10/h4-7,11,13H,3,8H2,1-2H3/t11-/m1/s1 |
| InChIKey | YGCZMODLNTWXLW-LLVKDONJSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C(C(=O)OCC)[C@](C=1C=CC(=CC1)C)(O)[H] |