| SpectraBase Compound ID | 2akNK2LC9CK |
|---|---|
| InChI | InChI=1S/C13H11ClF4O4/c14-8-2-1-3-9(6-8)22-11(20)5-4-10(19)21-7-13(17,18)12(15)16/h1-3,6,12H,4-5,7H2 |
| InChIKey | VMYUTFJYILVOGE-UHFFFAOYSA-N |
| Mol Weight | 342.67 g/mol |
| Molecular Formula | C13H11ClF4O4 |
| Exact Mass | 342.028199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 83j9XXclk2R |
|---|---|
| Name | Succinic acid, 2,2,3,3-tetrafluoropropyl 3-chlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.028199182 u |
| Formula | C13H11ClF4O4 |
| InChI | InChI=1S/C13H11ClF4O4/c14-8-2-1-3-9(6-8)22-11(20)5-4-10(19)21-7-13(17,18)12(15)16/h1-3,6,12H,4-5,7H2 |
| InChIKey | VMYUTFJYILVOGE-UHFFFAOYSA-N |
| Molecular Weight | 342.674 g/mol |
| SMILES | C(CC(OCC(C(F)F)(F)F)=O)C(OC1=CC(=CC=C1)Cl)=O |