| SpectraBase Compound ID | 1lG1y5MJ4K2 |
|---|---|
| InChI | InChI=1S/C12H17F3N2O2S/c1-16(2)8-9-17(3)20(18,19)11-6-4-10(5-7-11)12(13,14)15/h4-7H,8-9H2,1-3H3 |
| InChIKey | ZZFCPXJWDSLDDR-UHFFFAOYSA-N |
| Mol Weight | 310.34 g/mol |
| Molecular Formula | C12H17F3N2O2S |
| Exact Mass | 310.096283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9qEsDqXt2oC |
|---|---|
| Name | N-(2-(Dimethylamino)ethyl)-N-methyl-4-(trifluoromethyl)benzenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.096283456 u |
| Formula | C12H17F3N2O2S |
| InChI | InChI=1S/C12H17F3N2O2S/c1-16(2)8-9-17(3)20(18,19)11-6-4-10(5-7-11)12(13,14)15/h4-7H,8-9H2,1-3H3 |
| InChIKey | ZZFCPXJWDSLDDR-UHFFFAOYSA-N |
| Molecular Weight | 310.335 g/mol |
| SMILES | CN(C)CCN(C)S(=O)(=O)C=1C=CC(C(F)(F)F)=CC1 |