| SpectraBase Compound ID | KN4dHAkuACR |
|---|---|
| InChI | InChI=1S/C11H13FO2/c1-8(2)14-11(13)7-9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChIKey | IYIKCHGJPDZVPN-UHFFFAOYSA-N |
| Mol Weight | 196.22 g/mol |
| Molecular Formula | C11H13FO2 |
| Exact Mass | 196.089958 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IsqtPmVAhXY |
|---|---|
| Name | Acetic acid, 2-(4-fluorophenyl)-, isopropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.089957820 u |
| Formula | C11H13FO2 |
| InChI | InChI=1S/C11H13FO2/c1-8(2)14-11(13)7-9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChIKey | IYIKCHGJPDZVPN-UHFFFAOYSA-N |
| Molecular Weight | 196.221 g/mol |
| SMILES | C(OC(C)C)(=O)CC1=CC=C(C=C1)F |