| SpectraBase Compound ID | 1qprWHXPR5G |
|---|---|
| InChI | InChI=1S/C10H11Cl2NOS/c1-6(2)15-10(14)13-9-7(11)4-3-5-8(9)12/h3-6H,1-2H3,(H,13,14) |
| InChIKey | RRCDDSCKQMFASM-UHFFFAOYSA-N |
| Mol Weight | 264.17 g/mol |
| Molecular Formula | C10H11Cl2NOS |
| Exact Mass | 262.993841 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EiZaZdbzlkr |
|---|---|
| Name | 2,6-Dichlorothiocarbanilic acid, S-isopropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.993840551 u |
| Formula | C10H11Cl2NOS |
| InChI | InChI=1S/C10H11Cl2NOS/c1-6(2)15-10(14)13-9-7(11)4-3-5-8(9)12/h3-6H,1-2H3,(H,13,14) |
| InChIKey | RRCDDSCKQMFASM-UHFFFAOYSA-N |
| Molecular Weight | 264.170 g/mol |
| SMILES | N(C1=C(C=CC=C1Cl)Cl)C(SC(C)C)=O |