![2-[(4-Methylphenyl)sulfanyl]-1-phenylethanone](/api/spectrum/B0NPItZvJ2y/structure.png?h=300&w=458 "2-[(4-Methylphenyl)sulfanyl]-1-phenylethanone")
| SpectraBase Compound ID | J71skPIVlQI |
|---|---|
| InChI | InChI=1S/C15H14OS/c1-12-7-9-14(10-8-12)17-11-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey | WHROXXMOHVGXJU-UHFFFAOYSA-N |
| Mol Weight | 242.34 g/mol |
| Molecular Formula | C15H14OS |
| Exact Mass | 242.076536 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | B0NPItZvJ2y |
|---|---|
| Name | 2-[(4-Methylphenyl)sulfanyl]-1-phenylethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.076536244 u |
| Formula | C15H14OS |
| InChI | InChI=1S/C15H14OS/c1-12-7-9-14(10-8-12)17-11-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey | WHROXXMOHVGXJU-UHFFFAOYSA-N |
| Molecular Weight | 242.336 g/mol |
| SMILES | C(CSC=1C=CC(=CC1)C)(C=1C=CC=CC1)=O |