| SpectraBase Compound ID | JWRVPKk3ByA |
|---|---|
| InChI | InChI=1S/C16H25ClF4O4/c17-10-5-3-1-2-4-6-11-24-13(22)8-7-9-14(23)25-12-16(20,21)15(18)19/h15H,1-12H2 |
| InChIKey | SPMOJZIGRAGHQA-UHFFFAOYSA-N |
| Mol Weight | 392.82 g/mol |
| Molecular Formula | C16H25ClF4O4 |
| Exact Mass | 392.13775 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KZxrX413FI7 |
|---|---|
| Name | Glutaric acid, 2,2,3,3-tetrafluoropropyl 8-chlorooctyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.137749633 u |
| Formula | C16H25ClF4O4 |
| InChI | InChI=1S/C16H25ClF4O4/c17-10-5-3-1-2-4-6-11-24-13(22)8-7-9-14(23)25-12-16(20,21)15(18)19/h15H,1-12H2 |
| InChIKey | SPMOJZIGRAGHQA-UHFFFAOYSA-N |
| Molecular Weight | 392.819 g/mol |
| SMILES | C(CCC(OCC(C(F)F)(F)F)=O)C(OCCCCCCCCCl)=O |