| SpectraBase Compound ID | 1p0pa9m0od9 |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-15-12(14)9-11(7-8-13)10-5-3-2-4-6-10/h2-6,8,11H,7,9H2,1H3/t11-/m1/s1 |
| InChIKey | YWOJVMHWYVIKIW-LLVKDONJSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 19CUw80j6HX |
|---|---|
| Name | Methyl-(3R)-(-)-5-oxo-3-phenylpentanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.094294308 u |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-15-12(14)9-11(7-8-13)10-5-3-2-4-6-10/h2-6,8,11H,7,9H2,1H3/t11-/m1/s1 |
| InChIKey | YWOJVMHWYVIKIW-LLVKDONJSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | C(C[C@](C1=CC=CC=C1)(CC=O)[H])(=O)OC |