| SpectraBase Compound ID | 5PWO3UkA62t |
|---|---|
| InChI | InChI=1S/C11H13FO3/c1-8(15-9(2)13)7-14-11-5-3-10(12)4-6-11/h3-6,8H,7H2,1-2H3/t8-/m0/s1 |
| InChIKey | XNNQZIULAGYVBH-QMMMGPOBSA-N |
| Mol Weight | 212.22 g/mol |
| Molecular Formula | C11H13FO3 |
| Exact Mass | 212.084872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ixmrugr6wJN |
|---|---|
| Name | (S)-1-(4-Fluorophenoxy)-2-propanol, o-acetyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.084872439 u |
| Formula | C11H13FO3 |
| InChI | InChI=1S/C11H13FO3/c1-8(15-9(2)13)7-14-11-5-3-10(12)4-6-11/h3-6,8H,7H2,1-2H3/t8-/m0/s1 |
| InChIKey | XNNQZIULAGYVBH-QMMMGPOBSA-N |
| Molecular Weight | 212.220 g/mol |
| SMILES | C1(F)=CC=C(C=C1)OC[C@@](OC(=O)C)(C)[H] |