![3-(methylsulfinyl)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, ethyl ester](/api/spectrum/QRShBK3krk/structure.png?h=300&w=458 "3-(methylsulfinyl)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, ethyl ester")
| SpectraBase Compound ID | 5gYkOMJnc93 |
|---|---|
| InChI | InChI=1S/C12H14O4S2/c1-3-16-11(14)10-7-5-4-6-8(13)9(7)12(17-10)18(2)15/h3-6H2,1-2H3 |
| InChIKey | GCTHVQOLDZPMKG-UHFFFAOYSA-N |
| Mol Weight | 286.36 g/mol |
| Molecular Formula | C12H14O4S2 |
| Exact Mass | 286.033351 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | QRShBK3krk |
|---|---|
| Name | 3-(methylsulfinyl)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14O4S2 |
| InChI | InChI=1S/C12H14O4S2/c1-3-16-11(14)10-7-5-4-6-8(13)9(7)12(17-10)18(2)15/h3-6H2,1-2H3 |
| InChIKey | GCTHVQOLDZPMKG-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61066M |
| Solvent | CDCl3 |