| SpectraBase Compound ID | 5VU71cr6IxM |
|---|---|
| InChI | InChI=1S/C10H12O2S/c1-3-8-13(11)10-6-4-9(12-2)5-7-10/h3-7H,1,8H2,2H3 |
| InChIKey | NMJCYTGJFDSTTG-UHFFFAOYSA-N |
| Mol Weight | 196.26 g/mol |
| Molecular Formula | C10H12O2S |
| Exact Mass | 196.055801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3flc7P8P7UE |
|---|---|
| Name | 1-Methoxy-4-prop-2-enylsulfinyl-benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.055800798 u |
| Formula | C10H12O2S |
| InChI | InChI=1S/C10H12O2S/c1-3-8-13(11)10-6-4-9(12-2)5-7-10/h3-7H,1,8H2,2H3 |
| InChIKey | NMJCYTGJFDSTTG-UHFFFAOYSA-N |
| Molecular Weight | 196.264 g/mol |
| SMILES | C=1(S(=O)CC=C)C=CC(=CC1)OC |