| SpectraBase Compound ID | Ak1BU5Qo8Pg |
|---|---|
| InChI | InChI=1S/C11H13FO2/c1-11(2,3)10(13)14-9-6-4-5-8(12)7-9/h4-7H,1-3H3 |
| InChIKey | YCGXFJGUNIQXNR-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 | BdlD1Y1heF4 |
|---|---|
| Name | Pivalic acid, 3-fluorophenyl 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/c1-11(2,3)10(13)14-9-6-4-5-8(12)7-9/h4-7H,1-3H3 |
| InChIKey | YCGXFJGUNIQXNR-UHFFFAOYSA-N |
| Molecular Weight | 196.221 g/mol |
| SMILES | C(C(C)(C)C)(=O)OC1=CC=CC(=C1)F |