| SpectraBase Compound ID | 9ISTZkvmgw |
|---|---|
| InChI | InChI=1S/C15H18F2O4/c1-2-3-7-20-14(18)5-4-6-15(19)21-13-9-11(16)8-12(17)10-13/h8-10H,2-7H2,1H3 |
| InChIKey | HSKLIYWHMNVGTA-UHFFFAOYSA-N |
| Mol Weight | 300.3 g/mol |
| Molecular Formula | C15H18F2O4 |
| Exact Mass | 300.117315 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IAd8Yd1Fb9b |
|---|---|
| Name | Glutaric acid, butyl 3,5-difluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.117315382 u |
| Formula | C15H18F2O4 |
| InChI | InChI=1S/C15H18F2O4/c1-2-3-7-20-14(18)5-4-6-15(19)21-13-9-11(16)8-12(17)10-13/h8-10H,2-7H2,1H3 |
| InChIKey | HSKLIYWHMNVGTA-UHFFFAOYSA-N |
| Molecular Weight | 300.302 g/mol |
| SMILES | CCCCOC(CCCC(OC1=CC(=CC(=C1)F)F)=O)=O |