| SpectraBase Compound ID | CQdPDoISXCu |
|---|---|
| InChI | InChI=1S/C13H15NOS2/c1-9(2)11-8-17-13(16)14(11)12(15)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3 |
| InChIKey | GBUILUMZSODOCW-UHFFFAOYSA-N |
| Mol Weight | 265.39 g/mol |
| Molecular Formula | C13H15NOS2 |
| Exact Mass | 265.059506 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GIYuHdtSYjx |
|---|---|
| Name | (4-Isopropyl-2-thioxo-thiazolidin-3-yl)-phenyl-methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.059506454 u |
| Formula | C13H15NOS2 |
| InChI | InChI=1S/C13H15NOS2/c1-9(2)11-8-17-13(16)14(11)12(15)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3 |
| InChIKey | GBUILUMZSODOCW-UHFFFAOYSA-N |
| Molecular Weight | 265.389 g/mol |
| SMILES | C1(N(C(CS1)C(C)C)C(=O)C1=CC=CC=C1)=S |