| SpectraBase Compound ID | 3jhtravsdwx |
|---|---|
| InChI | InChI=1S/C5H11NOS/c1-6(2)5(7)3-4-8/h8H,3-4H2,1-2H3 |
| InChIKey | UXBJXJHRVOEYPA-UHFFFAOYSA-N |
| Mol Weight | 133.21 g/mol |
| Molecular Formula | C5H11NOS |
| Exact Mass | 133.056135 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2Eg9v9IpBxt |
|---|---|
| Name | N,N-Dimethyl-3-mercaptopropionamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 133.056135151 u |
| Formula | C5H11NOS |
| InChI | InChI=1S/C5H11NOS/c1-6(2)5(7)3-4-8/h8H,3-4H2,1-2H3 |
| InChIKey | UXBJXJHRVOEYPA-UHFFFAOYSA-N |
| Molecular Weight | 133.209 g/mol |
| SMILES | SCCC(=O)N(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.918017 |