| SpectraBase Compound ID | CADKZjt6ux3 |
|---|---|
| InChI | InChI=1S/C17H21FO4/c18-14-7-4-8-15(11-14)22-17(20)10-9-16(19)21-12-13-5-2-1-3-6-13/h4,7-8,11,13H,1-3,5-6,9-10,12H2 |
| InChIKey | GNGPJCZYNFYNJH-UHFFFAOYSA-N |
| Mol Weight | 308.35 g/mol |
| Molecular Formula | C17H21FO4 |
| Exact Mass | 308.142387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4SLzWTtypVU |
|---|---|
| Name | Succinic acid, cyclohexylmethyl 3-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.142387315 u |
| Formula | C17H21FO4 |
| InChI | InChI=1S/C17H21FO4/c18-14-7-4-8-15(11-14)22-17(20)10-9-16(19)21-12-13-5-2-1-3-6-13/h4,7-8,11,13H,1-3,5-6,9-10,12H2 |
| InChIKey | GNGPJCZYNFYNJH-UHFFFAOYSA-N |
| Molecular Weight | 308.349 g/mol |
| SMILES | C(CC(OCC1CCCCC1)=O)C(OC1=CC=CC(=C1)F)=O |