| SpectraBase Compound ID | 2qBsX9WlY48 |
|---|---|
| InChI | InChI=1S/C16H12Cl3NOS/c1-9-2-4-11(7-13(9)18)20-15(21)8-22-16(20)10-3-5-12(17)14(19)6-10/h2-7,16H,8H2,1H3 |
| InChIKey | ZVBZDNCMTOBXBP-UHFFFAOYSA-N |
| Mol Weight | 372.7 g/mol |
| Molecular Formula | C16H12Cl3NOS |
| Exact Mass | 370.970518 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AzMNtUCh15V |
|---|---|
| Name | 3-(3-Chloro-p-tolyl)-2-(3,4-dichlorophenyl)-4-thiazolidinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.970518283 u |
| Formula | C16H12Cl3NOS |
| InChI | InChI=1S/C16H12Cl3NOS/c1-9-2-4-11(7-13(9)18)20-15(21)8-22-16(20)10-3-5-12(17)14(19)6-10/h2-7,16H,8H2,1H3 |
| InChIKey | ZVBZDNCMTOBXBP-UHFFFAOYSA-N |
| Molecular Weight | 372.697 g/mol |
| SMILES | C=1C(=C(C=CC1C1SCC(N1C=1C=C(C(=CC1)C)Cl)=O)Cl)Cl |