| SpectraBase Compound ID | AQDxlFQjzRs |
|---|---|
| InChI | InChI=1S/C14H17FO3/c1-3-4-9-18-14(16)13(15)10-11-5-7-12(17-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3/b13-10+ |
| InChIKey | YETLVQXNBGVRPW-JLHYYAGUSA-N |
| Mol Weight | 252.29 g/mol |
| Molecular Formula | C14H17FO3 |
| Exact Mass | 252.116173 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Yzzv1WwKI9 |
|---|---|
| Name | (E)-Butyl-2-fluoro-3-(4-methoxyphenyl)-propenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.116172567 u |
| Formula | C14H17FO3 |
| InChI | InChI=1S/C14H17FO3/c1-3-4-9-18-14(16)13(15)10-11-5-7-12(17-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3/b13-10+ |
| InChIKey | YETLVQXNBGVRPW-JLHYYAGUSA-N |
| Molecular Weight | 252.285 g/mol |
| SMILES | C(OC(=O)\C(F)=C/C1=CC=C(OC)C=C1)CCC |