![5-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-[(METHYLSULFONYL)METHYL]-1,2,4-OXADIAZOLE](/api/spectrum/FL9bCJaXJbD/structure.png?h=300&w=458 "5-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-[(METHYLSULFONYL)METHYL]-1,2,4-OXADIAZOLE")
| SpectraBase Compound ID | CCeMnhlXLzK |
|---|---|
| InChI | InChI=1S/C12H8F6N2O3S/c1-24(21,22)5-9-19-10(23-20-9)6-2-7(11(13,14)15)4-8(3-6)12(16,17)18/h2-4H,5H2,1H3 |
| InChIKey | KICYWGFZHNQCNU-UHFFFAOYSA-N |
| Mol Weight | 374.26 g/mol |
| Molecular Formula | C12H8F6N2O3S |
| Exact Mass | 374.015982 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FL9bCJaXJbD |
|---|---|
| Name | 5-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-3-[(methylsulfonyl)methyl]-1,2,4-oxadiazole |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H8F6N2O3S |
| InChI | InChI=1S/C12H8F6N2O3S/c1-24(21,22)5-9-19-10(23-20-9)6-2-7(11(13,14)15)4-8(3-6)12(16,17)18/h2-4H,5H2,1H3 |
| InChIKey | KICYWGFZHNQCNU-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55733M |
| Solvent | Polysol |