| SpectraBase Compound ID | FvbHFvGiy7a |
|---|---|
| InChI | InChI=1S/C14H13F5O4/c1-2-5-22-8(20)3-4-9(21)23-6-7-10(15)12(17)14(19)13(18)11(7)16/h2-6H2,1H3 |
| InChIKey | PQXDCRDSQDKLKQ-UHFFFAOYSA-N |
| Mol Weight | 340.25 g/mol |
| Molecular Formula | C14H13F5O4 |
| Exact Mass | 340.0734 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5IWOnnT2ZTQ |
|---|---|
| Name | Succinic acid, pentafluorobenzyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.073399710 u |
| Formula | C14H13F5O4 |
| InChI | InChI=1S/C14H13F5O4/c1-2-5-22-8(20)3-4-9(21)23-6-7-10(15)12(17)14(19)13(18)11(7)16/h2-6H2,1H3 |
| InChIKey | PQXDCRDSQDKLKQ-UHFFFAOYSA-N |
| Molecular Weight | 340.246 g/mol |
| SMILES | C(C(OCC1=C(C(=C(C(=C1F)F)F)F)F)=O)CC(OCCC)=O |