| SpectraBase Compound ID | GJnSFkdkZg9 |
|---|---|
| InChI | InChI=1S/C11H10N2O3S/c14-9-6-12(7-10(15)16)11(17)13(9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16) |
| InChIKey | RKOKREQSBUSBRK-UHFFFAOYSA-N |
| Mol Weight | 250.27 g/mol |
| Molecular Formula | C11H10N2O3S |
| Exact Mass | 250.041213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ojOCRvltB6 |
|---|---|
| Name | 4-oxo-3-Phenyl-2-thioxo-1-imidazolidineacetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.041213361 u |
| Formula | C11H10N2O3S |
| InChI | InChI=1S/C11H10N2O3S/c14-9-6-12(7-10(15)16)11(17)13(9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16) |
| InChIKey | RKOKREQSBUSBRK-UHFFFAOYSA-N |
| Molecular Weight | 250.272 g/mol |
| SMILES | OC(CN1CC(N(C1=S)C1=CC=CC=C1)=O)=O |