| SpectraBase Compound ID | CCWGeK6yBrn |
|---|---|
| InChI | InChI=1S/C8H12Cl3NO2/c1-5-3-12(4-6(2)14-5)7(13)8(9,10)11/h5-6H,3-4H2,1-2H3 |
| InChIKey | WZNTZUNQQHXZTK-UHFFFAOYSA-N |
| Mol Weight | 260.55 g/mol |
| Molecular Formula | C8H12Cl3NO2 |
| Exact Mass | 258.993362 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7qC9CjIio9f |
|---|---|
| Name | 2,2,2-Trichloro-1-(2,6-dimethylmorpholin-4-yl) ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.993361728 u |
| Formula | C8H12Cl3NO2 |
| InChI | InChI=1S/C8H12Cl3NO2/c1-5-3-12(4-6(2)14-5)7(13)8(9,10)11/h5-6H,3-4H2,1-2H3 |
| InChIKey | WZNTZUNQQHXZTK-UHFFFAOYSA-N |
| SMILES | C1(OC(CN(C1)C(C(Cl)(Cl)Cl)=O)C)C |