| SpectraBase Compound ID | 9pLcI2UTHz6 |
|---|---|
| InChI | InChI=1S/C17H18OS/c1-3-8-16(9-4-1)14-18-12-7-13-19-15-17-10-5-2-6-11-17/h1-11,13H,12,14-15H2/b13-7+ |
| InChIKey | JWYAGCIFICLSCT-NTUHNPAUSA-N |
| Mol Weight | 270.39 g/mol |
| Molecular Formula | C17H18OS |
| Exact Mass | 270.107836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2wgGK9NwK02 |
|---|---|
| Name | Benzyl 3-(phenoxy)propenyl sulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.107836373 u |
| Formula | C17H18OS |
| InChI | InChI=1S/C17H18OS/c1-3-8-16(9-4-1)14-18-12-7-13-19-15-17-10-5-2-6-11-17/h1-11,13H,12,14-15H2/b13-7+ |
| InChIKey | JWYAGCIFICLSCT-NTUHNPAUSA-N |
| SMILES | C(S\C=C\COCC=1C=CC=CC1)C=1C=CC=CC1 |