| SpectraBase Compound ID | CuOPGxzjx2l |
|---|---|
| InChI | InChI=1S/C15H16O2S/c1-12-3-7-14(8-4-12)11-18(16,17)15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3 |
| InChIKey | YPJOHDQJXCJQOH-UHFFFAOYSA-N |
| Mol Weight | 260.35 g/mol |
| Molecular Formula | C15H16O2S |
| Exact Mass | 260.087101 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 | eYmN1vCY4g |
|---|---|
| Name | 1-Methyl-4-(p-tolylsulfonylmethyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.087100927 u |
| Formula | C15H16O2S |
| InChI | InChI=1S/C15H16O2S/c1-12-3-7-14(8-4-12)11-18(16,17)15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3 |
| InChIKey | YPJOHDQJXCJQOH-UHFFFAOYSA-N |
| Molecular Weight | 260.351 g/mol |
| SMILES | C=1(S(CC2=CC=C(C=C2)C)(=O)=O)C=CC(=CC1)C |