| SpectraBase Compound ID | 6Xs2BR5eGh |
|---|---|
| InChI | InChI=1S/C11H11IOS2/c1-14-11(15-2)7-10(13)8-3-5-9(12)6-4-8/h3-7H,1-2H3 |
| InChIKey | WKUYSQXVJNGGIP-UHFFFAOYSA-N |
| Mol Weight | 350.23 g/mol |
| Molecular Formula | C11H11IOS2 |
| Exact Mass | 349.929602 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GglTxANwyZE |
|---|---|
| Name | 1,1-bis(Methylthio)-2-(4'-iodobenzoyl)ethene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.929602321 u |
| Formula | C11H11IOS2 |
| InChI | InChI=1S/C11H11IOS2/c1-14-11(15-2)7-10(13)8-3-5-9(12)6-4-8/h3-7H,1-2H3 |
| InChIKey | WKUYSQXVJNGGIP-UHFFFAOYSA-N |
| Molecular Weight | 350.232 g/mol |
| SMILES | C(C(C1=CC=C(C=C1)I)=O)=C(SC)SC |