![p-[Methylthio]cinnamic acid](/api/spectrum/HnAhIadC5vR/structure.png?h=300&w=458 "p-[Methylthio]cinnamic acid")
| SpectraBase Compound ID | rg2X9UYbOY |
|---|---|
| InChI | InChI=1S/C10H10O2S/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-4+ |
| InChIKey | AHBHKZCSIUIANZ-QPJJXVBHSA-N |
| Mol Weight | 194.25 g/mol |
| Molecular Formula | C10H10O2S |
| Exact Mass | 194.040151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HnAhIadC5vR |
|---|---|
| Name | p-[Methylthio]cinnamic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.040150734 u |
| Formula | C10H10O2S |
| InChI | InChI=1S/C10H10O2S/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-4+ |
| InChIKey | AHBHKZCSIUIANZ-QPJJXVBHSA-N |
| Molecular Weight | 194.248 g/mol |
| SMILES | C1=C(\C=C\C(O)=O)C=CC(=C1)SC |