| SpectraBase Compound ID | 2BEJ35b8eLC |
|---|---|
| InChI | InChI=1S/C19H27FO4/c1-2-3-4-5-14-23-18(21)7-6-8-19(22)24-15-13-16-9-11-17(20)12-10-16/h9-12H,2-8,13-15H2,1H3 |
| InChIKey | SQQWYFXPGUSZCC-UHFFFAOYSA-N |
| Mol Weight | 338.42 g/mol |
| Molecular Formula | C19H27FO4 |
| Exact Mass | 338.189338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CQ8YaYkMfYd |
|---|---|
| Name | Glutaric acid, 2-(4-fluorophenyl)ethyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.189337508 u |
| Formula | C19H27FO4 |
| InChI | InChI=1S/C19H27FO4/c1-2-3-4-5-14-23-18(21)7-6-8-19(22)24-15-13-16-9-11-17(20)12-10-16/h9-12H,2-8,13-15H2,1H3 |
| InChIKey | SQQWYFXPGUSZCC-UHFFFAOYSA-N |
| Molecular Weight | 338.419 g/mol |
| SMILES | C(OCCC1=CC=C(C=C1)F)(=O)CCCC(OCCCCCC)=O |