| SpectraBase Compound ID | ID7703eViK0 |
|---|---|
| InChI | InChI=1S/C12H11Cl2NO2/c1-4-12(2,3)17-11(16)15-8-5-6-9(13)10(14)7-8/h1,5-7H,2-3H3,(H,15,16) |
| InChIKey | WKRVVHPEZNZOEE-UHFFFAOYSA-N |
| Mol Weight | 272.13 g/mol |
| Molecular Formula | C12H11Cl2NO2 |
| Exact Mass | 271.016684 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1AJYCS31Ozp |
|---|---|
| Name | Carbanilic acid, 3,4-dichloro-, 1,1-dimethyl-2-propynyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.016683996 u |
| Formula | C12H11Cl2NO2 |
| InChI | InChI=1S/C12H11Cl2NO2/c1-4-12(2,3)17-11(16)15-8-5-6-9(13)10(14)7-8/h1,5-7H,2-3H3,(H,15,16) |
| InChIKey | WKRVVHPEZNZOEE-UHFFFAOYSA-N |
| SMILES | N(C1=CC=C(C(=C1)Cl)Cl)C(OC(C)(C#C)C)=O |