| SpectraBase Compound ID | JkDzq83kwyL |
|---|---|
| InChI | InChI=1S/C16H21FO4/c1-3-12(4-2)11-20-15(18)9-10-16(19)21-14-8-6-5-7-13(14)17/h5-8,12H,3-4,9-11H2,1-2H3 |
| InChIKey | HGEANLRHDJZHQT-UHFFFAOYSA-N |
| Mol Weight | 296.34 g/mol |
| Molecular Formula | C16H21FO4 |
| Exact Mass | 296.142387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1AdB60srUwi |
|---|---|
| Name | Succinic acid, 2-fluorophenyl 2-ethylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.142387315 u |
| Formula | C16H21FO4 |
| InChI | InChI=1S/C16H21FO4/c1-3-12(4-2)11-20-15(18)9-10-16(19)21-14-8-6-5-7-13(14)17/h5-8,12H,3-4,9-11H2,1-2H3 |
| InChIKey | HGEANLRHDJZHQT-UHFFFAOYSA-N |
| Molecular Weight | 296.338 g/mol |
| SMILES | C(CC(OC1=CC=CC=C1F)=O)C(OCC(CC)CC)=O |