| SpectraBase Compound ID | 4TlO0WX1HlK |
|---|---|
| InChI | InChI=1S/C13H16OS/c1-14-11-7-9-13(10-8-11)15-12-5-3-2-4-6-12/h3,5,7-10,12H,2,4,6H2,1H3 |
| InChIKey | RWRRTBSBTQXPPZ-UHFFFAOYSA-N |
| Mol Weight | 220.33 g/mol |
| Molecular Formula | C13H16OS |
| Exact Mass | 220.092186 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3bFf6vJVREe |
|---|---|
| Name | Cyclohex-2-enyl(4-methoxyphenyl)sulfane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.092186308 u |
| Formula | C13H16OS |
| InChI | InChI=1S/C13H16OS/c1-14-11-7-9-13(10-8-11)15-12-5-3-2-4-6-12/h3,5,7-10,12H,2,4,6H2,1H3 |
| InChIKey | RWRRTBSBTQXPPZ-UHFFFAOYSA-N |
| Molecular Weight | 220.330 g/mol |
| SMILES | C=1(SC2C=CCCC2)C=CC(=CC1)OC |