| SpectraBase Compound ID | CJLaXWb5K4j |
|---|---|
| InChI | InChI=1S/C12H5F13/c13-7(14,6-4-2-1-3-5-6)8(15,16)9(17,18)10(19,20)11(21,22)12(23,24)25/h1-5H |
| InChIKey | CDMCLELUDINUDU-UHFFFAOYSA-N |
| Mol Weight | 396.15 g/mol |
| Molecular Formula | C12H5F13 |
| Exact Mass | 396.018366 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Xd1Z45gQIZ |
|---|---|
| Name | (Tridecafluorohexyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 396.018366280 u |
| Formula | C12H5F13 |
| InChI | InChI=1S/C12H5F13/c13-7(14,6-4-2-1-3-5-6)8(15,16)9(17,18)10(19,20)11(21,22)12(23,24)25/h1-5H |
| InChIKey | CDMCLELUDINUDU-UHFFFAOYSA-N |
| Molecular Weight | 396.151 g/mol |
| SMILES | C1(=CC=CC=C1)C(F)(F)C(F)(F)C(F)(F)C(F)(C(C(F)(F)F)(F)F)F |