![(E)-6-[(R)-(p-Tolylsulfinyl)]-5-hexen-1-ol](/api/spectrum/JNisRY32fFv/structure.png?h=300&w=458 "(E)-6-[(R)-(p-Tolylsulfinyl)]-5-hexen-1-ol")
| SpectraBase Compound ID | 1t8izoCOVtZ |
|---|---|
| InChI | InChI=1S/C13H18O2S/c1-12-6-8-13(9-7-12)16(15)11-5-3-2-4-10-14/h5-9,11,14H,2-4,10H2,1H3/b11-5+ |
| InChIKey | WRLHOIQNNZGWGZ-VZUCSPMQSA-N |
| Mol Weight | 238.34 g/mol |
| Molecular Formula | C13H18O2S |
| Exact Mass | 238.102751 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JNisRY32fFv |
|---|---|
| Name | (E)-6-[(R)-(p-Tolylsulfinyl)]-5-hexen-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.102750992 u |
| Formula | C13H18O2S |
| InChI | InChI=1S/C13H18O2S/c1-12-6-8-13(9-7-12)16(15)11-5-3-2-4-10-14/h5-9,11,14H,2-4,10H2,1H3/b11-5+ |
| InChIKey | WRLHOIQNNZGWGZ-VZUCSPMQSA-N |
| Molecular Weight | 238.345 g/mol |
| SMILES | C=1([S@@](\C=C\CCCCO)=O)C=CC(=CC1)C |