| SpectraBase Compound ID | 5nAPZPNOq8R |
|---|---|
| InChI | InChI=1S/C11H14OS/c1-2-9-13(12)10-8-11-6-4-3-5-7-11/h3-8,10H,2,9H2,1H3/b10-8+ |
| InChIKey | MOWSAIVKAWOCIP-CSKARUKUSA-N |
| Mol Weight | 194.29 g/mol |
| Molecular Formula | C11H14OS |
| Exact Mass | 194.076536 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCroPYMvtu4 |
|---|---|
| Name | (E)-1-Propylsulfinyl-2-phenylethene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.076536244 u |
| Formula | C11H14OS |
| InChI | InChI=1S/C11H14OS/c1-2-9-13(12)10-8-11-6-4-3-5-7-11/h3-8,10H,2,9H2,1H3/b10-8+ |
| InChIKey | MOWSAIVKAWOCIP-CSKARUKUSA-N |
| Molecular Weight | 194.292 g/mol |
| SMILES | C1=CC(=CC=C1)\C=C\S(=O)CCC |