| SpectraBase Compound ID | ALPgKwJYsOl |
|---|---|
| InChI | InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9) |
| InChIKey | PWKSKIMOESPYIA-UHFFFAOYSA-N |
| Mol Weight | 163.19 g/mol |
| Molecular Formula | C5H9NO3S |
| Exact Mass | 163.030314 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 47TBZ8E0CDH |
|---|---|
| Name | N-Acetyl-L-(+)-cysteine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.030314325 u |
| Formula | C5H9NO3S |
| InChI | InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9) |
| InChIKey | PWKSKIMOESPYIA-UHFFFAOYSA-N |
| SMILES | SCC(C(O)=O)NC(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.906457 |