![2-[(4-Methoxyphenyl)sulfanyl]-1,3,5-trimethylbenzene](/api/spectrum/JQZ0a4hJ5lt/structure.png?h=300&w=458 "2-[(4-Methoxyphenyl)sulfanyl]-1,3,5-trimethylbenzene")
| SpectraBase Compound ID | JFKGV4ChSdA |
|---|---|
| InChI | InChI=1S/C16H18OS/c1-11-9-12(2)16(13(3)10-11)18-15-7-5-14(17-4)6-8-15/h5-10H,1-4H3 |
| InChIKey | JUCOTJKNSAGSJA-UHFFFAOYSA-N |
| Mol Weight | 258.38 g/mol |
| Molecular Formula | C16H18OS |
| Exact Mass | 258.107836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JQZ0a4hJ5lt |
|---|---|
| Name | 2-[(4-Methoxyphenyl)sulfanyl]-1,3,5-trimethylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.107836373 u |
| Formula | C16H18OS |
| InChI | InChI=1S/C16H18OS/c1-11-9-12(2)16(13(3)10-11)18-15-7-5-14(17-4)6-8-15/h5-10H,1-4H3 |
| InChIKey | JUCOTJKNSAGSJA-UHFFFAOYSA-N |
| Molecular Weight | 258.379 g/mol |
| SMILES | C=1(C(=C(C=C(C1)C)C)SC=1C=CC(=CC1)OC)C |