| SpectraBase Compound ID | F9OcNQgpkQG |
|---|---|
| InChI | InChI=1S/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey | MSEBQGULDWDIRW-UHFFFAOYSA-N |
| Mol Weight | 154.14 g/mol |
| Molecular Formula | C8H7FO2 |
| Exact Mass | 154.043008 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KoHXyTiEWC |
|---|---|
| Name | 4-Fluorobenzoic-acid, methylester |
| CAS Registry Number | 403-33-8 |
| Comments | enrichment/labelling |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H7FO2 |
| InChI | InChI=1S/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey | MSEBQGULDWDIRW-UHFFFAOYSA-N |
| Instrument Name | SF = 270 MHz |
| Literature Reference | Org. Magn. Resonance 22, 753 (1984). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | Acetone |