| 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 |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DB5Ik8IAnVf |
|---|---|
| Name | 3-(acetylthio)propionic acid |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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 |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 148.177 g/mol |
| Source File Reference | MHKO20439 |