| SpectraBase Compound ID | 8IPtYJlMpOz |
|---|---|
| InChI | InChI=1S/C18H29F3O4/c1-3-4-5-6-7-8-9-10-14-24-16(22)12-11-13-17(23)25-15(2)18(19,20)21/h3,15H,1,4-14H2,2H3 |
| InChIKey | CKHSRUUQLGOMAR-UHFFFAOYSA-N |
| Mol Weight | 366.42 g/mol |
| Molecular Formula | C18H29F3O4 |
| Exact Mass | 366.201794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9cd8tYH42Yq |
|---|---|
| Name | Glutaric acid, 1,1,1-trifluoroprop-2-yl dec-9-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 366.201793899 u |
| Formula | C18H29F3O4 |
| InChI | InChI=1S/C18H29F3O4/c1-3-4-5-6-7-8-9-10-14-24-16(22)12-11-13-17(23)25-15(2)18(19,20)21/h3,15H,1,4-14H2,2H3 |
| InChIKey | CKHSRUUQLGOMAR-UHFFFAOYSA-N |
| Molecular Weight | 366.421 g/mol |
| SMILES | C(CCC(OC(C)C(F)(F)F)=O)C(OCCCCCCCCC=C)=O |