| SpectraBase Compound ID | 29lTDKHGNiU |
|---|---|
| InChI | InChI=1S/C12H12F6N2S.HI/c1-20(2)10(21-3)19-9-5-7(11(13,14)15)4-8(6-9)12(16,17)18;/h4-6H,1-3H3;1H/b19-10-; |
| InChIKey | NEHUBZDDYPPNCI-PEZBNFGJSA-N |
| Mol Weight | 458.205 g/mol |
| Molecular Formula | C12H13F6IN2S |
| Exact Mass | 457.974834 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 531XDW0lsTF |
|---|---|
| Name | 3,3-dimethyl-1-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2-methyl-2-thiopseudourea, monohydroiodide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13F6IN2S |
| InChI | InChI=1S/C12H12F6N2S.HI/c1-20(2)10(21-3)19-9-5-7(11(13,14)15)4-8(6-9)12(16,17)18;/h4-6H,1-3H3;1H/b19-10-; |
| InChIKey | NEHUBZDDYPPNCI-PEZBNFGJSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 33535M |
| Solvent | Polysol |