| SpectraBase Compound ID | 3VNlhjRcsqD |
|---|---|
| InChI | InChI=1S/C12H15FO2/c1-2-3-8-15-12(14)9-10-4-6-11(13)7-5-10/h4-7H,2-3,8-9H2,1H3 |
| InChIKey | BYWPGOPECVFGNK-UHFFFAOYSA-N |
| Mol Weight | 210.25 g/mol |
| Molecular Formula | C12H15FO2 |
| Exact Mass | 210.105608 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AsEcR64Bh0K |
|---|---|
| Name | Acetic acid, 2-(4-fluorophenyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.105607884 u |
| Formula | C12H15FO2 |
| InChI | InChI=1S/C12H15FO2/c1-2-3-8-15-12(14)9-10-4-6-11(13)7-5-10/h4-7H,2-3,8-9H2,1H3 |
| InChIKey | BYWPGOPECVFGNK-UHFFFAOYSA-N |
| Molecular Weight | 210.248 g/mol |
| SMILES | C(OCCCC)(=O)CC1=CC=C(C=C1)F |