| SpectraBase Compound ID | AOhnQ0pv8oh |
|---|---|
| InChI | InChI=1S/C11H10O3S/c1-9-2-4-10(5-3-9)15(14)11(8-13)6-7-12/h2-8H,1H3/b11-6+ |
| InChIKey | RYMBAENIVNJLND-IZZDOVSWSA-N |
| Mol Weight | 222.26 g/mol |
| Molecular Formula | C11H10O3S |
| Exact Mass | 222.035065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BHlhjerOy3E |
|---|---|
| Name | (+)-(2E,SS)-2-(p-Tolylsulfinyl)-2-buten-1,4-dial |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H10O3S |
| InChI | InChI=1S/C11H10O3S/c1-9-2-4-10(5-3-9)15(14)11(8-13)6-7-12/h2-8H,1H3/b11-6+ |
| InChIKey | RYMBAENIVNJLND-IZZDOVSWSA-N |
| Molecular Weight | 222.258 g/mol |
| SMILES | C(\C=C/([S@](c1ccc(cc1)C)=O)C=O)=O |
| SPLASH | splash10-007c-4900000000-13db8426bbcce746197a |
| Source of Spectrum | QC-11-1189-2 |
| Wiley ID | 859689 |