| SpectraBase Compound ID | 7oMnTba1jbh |
|---|---|
| InChI | InChI=1S/C16H20F2O4/c1-10(2)9-21-14(19)7-8-15(20)22-11(3)16-12(17)5-4-6-13(16)18/h4-6,10-11H,7-9H2,1-3H3 |
| InChIKey | UVEKJCXLQQOMPH-UHFFFAOYSA-N |
| Mol Weight | 314.33 g/mol |
| Molecular Formula | C16H20F2O4 |
| Exact Mass | 314.132965 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HAYDvxEPGFO |
|---|---|
| Name | Succinic acid, 1-(2,6-difluorophenyl)ethyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.132965446 u |
| Formula | C16H20F2O4 |
| InChI | InChI=1S/C16H20F2O4/c1-10(2)9-21-14(19)7-8-15(20)22-11(3)16-12(17)5-4-6-13(16)18/h4-6,10-11H,7-9H2,1-3H3 |
| InChIKey | UVEKJCXLQQOMPH-UHFFFAOYSA-N |
| Molecular Weight | 314.329 g/mol |
| SMILES | C(CCC(OC(C1=C(C=CC=C1F)F)C)=O)(OCC(C)C)=O |