| SpectraBase Compound ID | KWd7iKxTNvO |
|---|---|
| InChI | InChI=1S/C16H29F3O2/c1-3-5-6-7-8-9-10-11-13-14(12-4-2)21-15(20)16(17,18)19/h14H,3-13H2,1-2H3 |
| InChIKey | KZJLVDJODJVDLQ-UHFFFAOYSA-N |
| Mol Weight | 310.4 g/mol |
| Molecular Formula | C16H29F3O2 |
| Exact Mass | 310.211965 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3JD7Q7ZTgLC |
|---|---|
| Name | 4-Trifluoroacetoxytetradecane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.211964661 u |
| Formula | C16H29F3O2 |
| InChI | InChI=1S/C16H29F3O2/c1-3-5-6-7-8-9-10-11-13-14(12-4-2)21-15(20)16(17,18)19/h14H,3-13H2,1-2H3 |
| InChIKey | KZJLVDJODJVDLQ-UHFFFAOYSA-N |
| Molecular Weight | 310.401 g/mol |
| SMILES | C(C(CCCCCCCCCC)OC(C(F)(F)F)=O)CC |