![6,6-dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, allyl ester](/api/spectrum/8D6dQM3T5o9/structure.png?h=300&w=458 "6,6-dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, allyl ester")
| SpectraBase Compound ID | 3EyzyGkswKB |
|---|---|
| InChI | InChI=1S/C15H18O3S2/c1-5-6-18-13(17)12-9-7-15(2,3)8-10(16)11(9)14(19-4)20-12/h5H,1,6-8H2,2-4H3 |
| InChIKey | UJNLNXZKNLKQAC-UHFFFAOYSA-N |
| Mol Weight | 310.43 g/mol |
| Molecular Formula | C15H18O3S2 |
| Exact Mass | 310.069737 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8D6dQM3T5o9 |
|---|---|
| Name | 6,6-dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, allyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H18O3S2 |
| InChI | InChI=1S/C15H18O3S2/c1-5-6-18-13(17)12-9-7-15(2,3)8-10(16)11(9)14(19-4)20-12/h5H,1,6-8H2,2-4H3 |
| InChIKey | UJNLNXZKNLKQAC-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61259M |
| Solvent | CDCl3 |