| SpectraBase Compound ID | 6tpsuq1M7oR |
|---|---|
| InChI | InChI=1S/C19H25FO4/c20-16-9-4-5-10-17(16)24-19(22)12-6-11-18(21)23-14-13-15-7-2-1-3-8-15/h4-5,9-10,15H,1-3,6-8,11-14H2 |
| InChIKey | HNEKSNRVXOLBNC-UHFFFAOYSA-N |
| Mol Weight | 336.4 g/mol |
| Molecular Formula | C19H25FO4 |
| Exact Mass | 336.173687 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DM0Ysn2IkKx |
|---|---|
| Name | Glutaric acid, 2-(cyclohexyl)ethyl 2-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.173687444 u |
| Formula | C19H25FO4 |
| InChI | InChI=1S/C19H25FO4/c20-16-9-4-5-10-17(16)24-19(22)12-6-11-18(21)23-14-13-15-7-2-1-3-8-15/h4-5,9-10,15H,1-3,6-8,11-14H2 |
| InChIKey | HNEKSNRVXOLBNC-UHFFFAOYSA-N |
| Molecular Weight | 336.403 g/mol |
| SMILES | C(CCC(OC1=CC=CC=C1F)=O)C(OCCC1CCCCC1)=O |