![[(1E)-1-octenylsulfinyl]benzene](/api/spectrum/BwZxwPLW16q/structure.png?h=300&w=458 "[(1E)-1-octenylsulfinyl]benzene")
| SpectraBase Compound ID | 9eSIrWoZtFw |
|---|---|
| InChI | InChI=1S/C14H20OS/c1-2-3-4-5-6-10-13-16(15)14-11-8-7-9-12-14/h7-13H,2-6H2,1H3/b13-10+ |
| InChIKey | FVLABTQAEJFPKU-JLHYYAGUSA-N |
| Mol Weight | 236.37 g/mol |
| Molecular Formula | C14H20OS |
| Exact Mass | 236.123486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BwZxwPLW16q |
|---|---|
| Name | [(1E)-1-Octenylsulfinyl]benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.123486437 u |
| Formula | C14H20OS |
| InChI | InChI=1S/C14H20OS/c1-2-3-4-5-6-10-13-16(15)14-11-8-7-9-12-14/h7-13H,2-6H2,1H3/b13-10+ |
| InChIKey | FVLABTQAEJFPKU-JLHYYAGUSA-N |
| Molecular Weight | 236.373 g/mol |
| SMILES | C(\C=C\S(=O)C=1C=CC=CC1)CCCCC |