| SpectraBase Compound ID | 7txvwwBShJn |
|---|---|
| InChI | InChI=1S/C12H15F3N2O/c1-3-17(4-2)11(18)16-10-7-5-6-9(8-10)12(13,14)15/h5-8H,3-4H2,1-2H3,(H,16,18) |
| InChIKey | BZWDWXFJYOSXNY-UHFFFAOYSA-N |
| Mol Weight | 260.26 g/mol |
| Molecular Formula | C12H15F3N2O |
| Exact Mass | 260.113648 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4m9u10p21Nl |
|---|---|
| Name | 1,1-Diethyl-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.113647599 u |
| Formula | C12H15F3N2O |
| InChI | InChI=1S/C12H15F3N2O/c1-3-17(4-2)11(18)16-10-7-5-6-9(8-10)12(13,14)15/h5-8H,3-4H2,1-2H3,(H,16,18) |
| InChIKey | BZWDWXFJYOSXNY-UHFFFAOYSA-N |
| Molecular Weight | 260.260 g/mol |
| SMILES | N(C1=CC=CC(=C1)C(F)(F)F)C(N(CC)CC)=O |