| SpectraBase Compound ID | hbpb3pIkhA |
|---|---|
| InChI | InChI=1S/C9H9FO2/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-6H,1H3,(H,11,12) |
| InChIKey | APTIEBMILUDOJX-UHFFFAOYSA-N |
| Mol Weight | 168.17 g/mol |
| Molecular Formula | C9H9FO2 |
| Exact Mass | 168.058658 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Dbe87dyiw2I |
|---|---|
| Name | 4-(1-Fluoroethyl)benzoic Acid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9FO2 |
| InChI | InChI=1S/C9H9FO2/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-6H,1H3,(H,11,12) |
| InChIKey | APTIEBMILUDOJX-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo5016757 |
| Molecular Weight | 168.167 g/mol |
| SMILES | OC(c1ccc(cc1)C(C)F)=O |
| SPLASH | splash10-0fk9-0900000000-129598609777bfa143c4 |
| Source of Spectrum | J-79-8489-2h |
| Wiley ID | 1748246 |