| SpectraBase Compound ID | JkXkm8BBiTa |
|---|---|
| InChI | InChI=1S/C15H19FO4/c1-11(2)9-19-14(17)6-7-15(18)20-10-12-4-3-5-13(16)8-12/h3-5,8,11H,6-7,9-10H2,1-2H3 |
| InChIKey | DAESUBIWTYUADX-UHFFFAOYSA-N |
| Mol Weight | 282.31 g/mol |
| Molecular Formula | C15H19FO4 |
| Exact Mass | 282.126737 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IJ6AisGN12Y |
|---|---|
| Name | Succinic acid, 3-fluorobenzyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.126737251 u |
| Formula | C15H19FO4 |
| InChI | InChI=1S/C15H19FO4/c1-11(2)9-19-14(17)6-7-15(18)20-10-12-4-3-5-13(16)8-12/h3-5,8,11H,6-7,9-10H2,1-2H3 |
| InChIKey | DAESUBIWTYUADX-UHFFFAOYSA-N |
| Molecular Weight | 282.311 g/mol |
| SMILES | C(CCC(OCC=1C=C(C=CC1)F)=O)(OCC(C)C)=O |