| SpectraBase Compound ID | 87mGsSI31bj |
|---|---|
| InChI | InChI=1S/C8H13F3/c1-2-3-4-5-6-7-8(9,10)11/h5-6H,2-4,7H2,1H3/b6-5+ |
| InChIKey | MENFQHLOYXZCGV-AATRIKPKSA-N |
| Mol Weight | 166.19 g/mol |
| Molecular Formula | C8H13F3 |
| Exact Mass | 166.096935 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DxaWQDIidn1 |
|---|---|
| Name | Trans-1,1,1-trifluoro-oct-3-ene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.096934908 u |
| Formula | C8H13F3 |
| InChI | InChI=1S/C8H13F3/c1-2-3-4-5-6-7-8(9,10)11/h5-6H,2-4,7H2,1H3/b6-5+ |
| InChIKey | MENFQHLOYXZCGV-AATRIKPKSA-N |
| Molecular Weight | 166.187 g/mol |
| SMILES | C(F)(F)(F)C\C=C\CCCC |