![p-[(2-Propynyl)sulfonyl]anisole](/api/spectrum/Loqngdg4VCK/structure.png?h=300&w=458 "p-[(2-Propynyl)sulfonyl]anisole")
| SpectraBase Compound ID | CCOEjsYkVM8 |
|---|---|
| InChI | InChI=1S/C10H10O3S/c1-3-8-14(11,12)10-6-4-9(13-2)5-7-10/h1,4-7H,8H2,2H3 |
| InChIKey | JXZVBNYCKUEVLV-UHFFFAOYSA-N |
| Mol Weight | 210.25 g/mol |
| Molecular Formula | C10H10O3S |
| Exact Mass | 210.035065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Loqngdg4VCK |
|---|---|
| Name | p-[(2-Propynyl)sulfonyl]anisole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.035065353 u |
| Formula | C10H10O3S |
| InChI | InChI=1S/C10H10O3S/c1-3-8-14(11,12)10-6-4-9(13-2)5-7-10/h1,4-7H,8H2,2H3 |
| InChIKey | JXZVBNYCKUEVLV-UHFFFAOYSA-N |
| Molecular Weight | 210.247 g/mol |
| SMILES | C=1C(=CC=C(C1)OC)S(=O)(=O)CC#C |