![1-Methyl-4-{[(E)-2-phenylethenyl]sulfinyl}benzene](/api/spectrum/Et3M4EFBX1d/structure.png?h=300&w=458 "1-Methyl-4-{[(E)-2-phenylethenyl]sulfinyl}benzene")
| SpectraBase Compound ID | LAZH2cDTsA6 |
|---|---|
| InChI | InChI=1S/C15H14OS/c1-13-7-9-15(10-8-13)17(16)12-11-14-5-3-2-4-6-14/h2-12H,1H3/b12-11+ |
| InChIKey | NZYCZBAOSXWZJS-VAWYXSNFSA-N |
| Mol Weight | 242.34 g/mol |
| Molecular Formula | C15H14OS |
| Exact Mass | 242.076536 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Et3M4EFBX1d |
|---|---|
| Name | 1-Methyl-4-[(E)-2-phenylethenyl]sulfinylbenzene |
| 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/c1-13-7-9-15(10-8-13)17(16)12-11-14-5-3-2-4-6-14/h2-12H,1H3/b12-11+ |
| InChIKey | NZYCZBAOSXWZJS-VAWYXSNFSA-N |
| Molecular Weight | 242.336 g/mol |
| SMILES | C=1(S(=O)\C=C\C2=CC=CC=C2)C=CC(C)=CC1 |