| SpectraBase Compound ID | 9jUN7XRwoAU |
|---|---|
| InChI | InChI=1S/C17H14F2O4/c18-12-4-1-6-14(10-12)22-16(20)8-3-9-17(21)23-15-7-2-5-13(19)11-15/h1-2,4-7,10-11H,3,8-9H2 |
| InChIKey | VRDCLTDCFLVVNE-UHFFFAOYSA-N |
| Mol Weight | 320.29 g/mol |
| Molecular Formula | C17H14F2O4 |
| Exact Mass | 320.086015 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4e1JtkpWp46 |
|---|---|
| Name | Glutaric acid, di(3-fluorophenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.086015253 u |
| Formula | C17H14F2O4 |
| InChI | InChI=1S/C17H14F2O4/c18-12-4-1-6-14(10-12)22-16(20)8-3-9-17(21)23-15-7-2-5-13(19)11-15/h1-2,4-7,10-11H,3,8-9H2 |
| InChIKey | VRDCLTDCFLVVNE-UHFFFAOYSA-N |
| Molecular Weight | 320.292 g/mol |
| SMILES | C1=CC=C(C=C1F)OC(CCCC(OC1=CC=CC(=C1)F)=O)=O |