| SpectraBase Compound ID | DiEsXt7vCwH |
|---|---|
| InChI | InChI=1S/C18H29F7O2/c1-3-5-6-7-8-9-10-11-12-13-14(4-2)27-15(26)16(19,20)17(21,22)18(23,24)25/h14H,3-13H2,1-2H3 |
| InChIKey | ZZFSNWJLVXEPBW-UHFFFAOYSA-N |
| Mol Weight | 410.42 g/mol |
| Molecular Formula | C18H29F7O2 |
| Exact Mass | 410.205577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IpqbyXgPdwF |
|---|---|
| Name | 3-Heptafluorobutyroxytetradecane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 410.205577313 u |
| Formula | C18H29F7O2 |
| InChI | InChI=1S/C18H29F7O2/c1-3-5-6-7-8-9-10-11-12-13-14(4-2)27-15(26)16(19,20)17(21,22)18(23,24)25/h14H,3-13H2,1-2H3 |
| InChIKey | ZZFSNWJLVXEPBW-UHFFFAOYSA-N |
| Molecular Weight | 410.417 g/mol |
| SMILES | C(C(CCCCCCCCCCC)OC(C(C(C(F)(F)F)(F)F)(F)F)=O)C |