| SpectraBase Compound ID | IKqemOOQxFr |
|---|---|
| InChI | InChI=1S/C5H8O3S/c1-4(6)9-3-2-5(7)8/h2-3H2,1H3,(H,7,8) |
| InChIKey | AYQXANXXZYKTDL-UHFFFAOYSA-N |
| Mol Weight | 148.18 g/mol |
| Molecular Formula | C5H8O3S |
| Exact Mass | 148.019415 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4rerKjTL6jn |
|---|---|
| Name | 3-Acetylthiopropionic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8O3S |
| InChI | InChI=1S/C5H8O3S/c1-4(6)9-3-2-5(7)8/h2-3H2,1H3,(H,7,8) |
| InChIKey | AYQXANXXZYKTDL-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 148.176 g/mol |
| SMILES | OC(=O)CCSC(C)=O |
| SPLASH | splash10-0006-9100000000-62d1a6cdd17d30462fa3 |
| Source of Spectrum | SRH-2022-12065-0 |
| Wiley ID | 1833593 |