| SpectraBase Compound ID | 56uMxIiM7lK |
|---|---|
| InChI | InChI=1S/C16H17NOS/c1-3-13-17-19(18,15-7-5-4-6-8-15)16-11-9-14(2)10-12-16/h3-12H,1,13H2,2H3/t19-/m1/s1 |
| InChIKey | ZDRCOGYFVADUFX-LJQANCHMSA-N |
| Mol Weight | 271.38 g/mol |
| Molecular Formula | C16H17NOS |
| Exact Mass | 271.103085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fk6i8lzG7p8 |
|---|---|
| Name | Sulfoximine, S-(4-methylphenyl)-S-phenyl-N-2-propenyl-, (R)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.103085344 u |
| Formula | C16H17NOS |
| InChI | InChI=1S/C16H17NOS/c1-3-13-17-19(18,15-7-5-4-6-8-15)16-11-9-14(2)10-12-16/h3-12H,1,13H2,2H3/t19-/m1/s1 |
| InChIKey | ZDRCOGYFVADUFX-LJQANCHMSA-N |
| SMILES | C1([S@](=NCC=C)(=O)C2=CC=CC=C2)=CC=C(C=C1)C |