| SpectraBase Compound ID | 5aoRZlTrJ6f |
|---|---|
| InChI | InChI=1S/C14H13F5O4/c15-9-3-1-4-10(7-9)23-12(21)6-2-5-11(20)22-8-14(18,19)13(16)17/h1,3-4,7,13H,2,5-6,8H2 |
| InChIKey | RMBNSIFXQVIZAD-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 | Ieshj0ceo5M |
|---|---|
| Name | Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-fluorophenyl 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/c15-9-3-1-4-10(7-9)23-12(21)6-2-5-11(20)22-8-14(18,19)13(16)17/h1,3-4,7,13H,2,5-6,8H2 |
| InChIKey | RMBNSIFXQVIZAD-UHFFFAOYSA-N |
| Molecular Weight | 340.246 g/mol |
| SMILES | C(CCC(OCC(C(F)F)(F)F)=O)C(OC1=CC=CC(=C1)F)=O |