| SpectraBase Compound ID | HWIy9mpksaP |
|---|---|
| InChI | InChI=1S/C23H35FO4/c1-2-3-4-5-6-7-8-9-18-27-22(25)11-10-12-23(26)28-19-17-20-13-15-21(24)16-14-20/h13-16H,2-12,17-19H2,1H3 |
| InChIKey | SEHCVPIRHHLHFP-UHFFFAOYSA-N |
| Mol Weight | 394.5 g/mol |
| Molecular Formula | C23H35FO4 |
| Exact Mass | 394.251938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BTChbMII4Ta |
|---|---|
| Name | Glutaric acid, decyl 2-(4-fluorophenyl)ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 394.251937766 u |
| Formula | C23H35FO4 |
| InChI | InChI=1S/C23H35FO4/c1-2-3-4-5-6-7-8-9-18-27-22(25)11-10-12-23(26)28-19-17-20-13-15-21(24)16-14-20/h13-16H,2-12,17-19H2,1H3 |
| InChIKey | SEHCVPIRHHLHFP-UHFFFAOYSA-N |
| Molecular Weight | 394.527 g/mol |
| SMILES | C(OCCC1=CC=C(C=C1)F)(=O)CCCC(OCCCCCCCCCC)=O |