| SpectraBase Compound ID | 73IPkOKD1sf |
|---|---|
| InChI | InChI=1S/C11H12O2S/c1-2-13-11(12)14-9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+ |
| InChIKey | MHBHVDGCJYNLRT-CMDGGOBGSA-N |
| Mol Weight | 208.27 g/mol |
| Molecular Formula | C11H12O2S |
| Exact Mass | 208.055801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BFGJogpPDDr |
|---|---|
| Name | (E)-Thiocarbonic acid-o-ethyl-S-styryl-diester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.055800798 u |
| Formula | C11H12O2S |
| InChI | InChI=1S/C11H12O2S/c1-2-13-11(12)14-9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+ |
| InChIKey | MHBHVDGCJYNLRT-CMDGGOBGSA-N |
| Molecular Weight | 208.275 g/mol |
| SMILES | C1(\C=C\SC(=O)OCC)=CC=CC=C1 |