| SpectraBase Compound ID | 3YI2dPIFVUr |
|---|---|
| InChI | InChI=1S/C10H8ClNOS2/c11-8-3-1-2-7(4-8)5-12-9(13)6-15-10(12)14/h1-4H,5-6H2 |
| InChIKey | PDHPDCZACQKAOP-UHFFFAOYSA-N |
| Mol Weight | 257.75 g/mol |
| Molecular Formula | C10H8ClNOS2 |
| Exact Mass | 256.973584 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A31HTRAlFPF |
|---|---|
| Name | 3-(m-Chlorobenzyl)rhodanine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.973583929 u |
| Formula | C10H8ClNOS2 |
| InChI | InChI=1S/C10H8ClNOS2/c11-8-3-1-2-7(4-8)5-12-9(13)6-15-10(12)14/h1-4H,5-6H2 |
| InChIKey | PDHPDCZACQKAOP-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=CC1Cl)CN1C(CSC1=S)=O |