![DL-5-[2-(methylthio)ethyl]hydantoin](/api/spectrum/AJZtpXsuA6A/structure.png?h=300&w=458 "DL-5-[2-(methylthio)ethyl]hydantoin")
| SpectraBase Compound ID | F9OrbSpyfZ4 |
|---|---|
| InChI | InChI=1S/C6H10N2O2S/c1-11-3-2-4-5(9)8-6(10)7-4/h4H,2-3H2,1H3,(H2,7,8,9,10) |
| InChIKey | SBKRXUMXMKBCLD-UHFFFAOYSA-N |
| Mol Weight | 174.22 g/mol |
| Molecular Formula | C6H10N2O2S |
| Exact Mass | 174.046299 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AJZtpXsuA6A |
|---|---|
| Name | 5-[2-(Methylthio)ethyl]hydantoin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.046298742 u |
| Formula | C6H10N2O2S |
| InChI | InChI=1S/C6H10N2O2S/c1-11-3-2-4-5(9)8-6(10)7-4/h4H,2-3H2,1H3,(H2,7,8,9,10) |
| InChIKey | SBKRXUMXMKBCLD-UHFFFAOYSA-N |
| Molecular Weight | 174.218 g/mol |
| SMILES | N1C(NC(C1CCSC)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.927049 |