| SpectraBase Compound ID | CnDTAJaZcb2 |
|---|---|
| InChI | InChI=1S/C11H12F2O2/c1-7(2)6-15-11(14)10-8(12)4-3-5-9(10)13/h3-5,7H,6H2,1-2H3 |
| InChIKey | VDRPRJNZPGMONV-UHFFFAOYSA-N |
| Mol Weight | 214.21 g/mol |
| Molecular Formula | C11H12F2O2 |
| Exact Mass | 214.080536 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | amYyjQDds0 |
|---|---|
| Name | 2,6-Difluorobenzoic acid, 2-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.080535950 u |
| Formula | C11H12F2O2 |
| InChI | InChI=1S/C11H12F2O2/c1-7(2)6-15-11(14)10-8(12)4-3-5-9(10)13/h3-5,7H,6H2,1-2H3 |
| InChIKey | VDRPRJNZPGMONV-UHFFFAOYSA-N |
| Molecular Weight | 214.212 g/mol |
| SMILES | C(OC(C=1C(=CC=CC1F)F)=O)C(C)C |