| SpectraBase Compound ID | KAxAGOa4zdC |
|---|---|
| InChI | InChI=1S/C16H26ClF3O4/c1-13(16(18,19)20)24-15(22)10-8-9-14(21)23-12-7-5-3-2-4-6-11-17/h13H,2-12H2,1H3 |
| InChIKey | FPMVLQWQZLNSLY-UHFFFAOYSA-N |
| Mol Weight | 374.83 g/mol |
| Molecular Formula | C16H26ClF3O4 |
| Exact Mass | 374.147172 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | COu8rS6hC2D |
|---|---|
| Name | Glutaric acid, 1,1,1-trifluoroprop-2-yl 8-chlorooctyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.147171502 u |
| Formula | C16H26ClF3O4 |
| InChI | InChI=1S/C16H26ClF3O4/c1-13(16(18,19)20)24-15(22)10-8-9-14(21)23-12-7-5-3-2-4-6-11-17/h13H,2-12H2,1H3 |
| InChIKey | FPMVLQWQZLNSLY-UHFFFAOYSA-N |
| Molecular Weight | 374.828 g/mol |
| SMILES | C(CCC(OC(C)C(F)(F)F)=O)C(OCCCCCCCCCl)=O |