![4-hydroxy-3-(methylsulfonyl)-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, ethyl ester](/api/spectrum/GOFCwTb0i2f/structure.png?h=300&w=458 "4-hydroxy-3-(methylsulfonyl)-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, ethyl ester")
| SpectraBase Compound ID | GBwtgkpH09A |
|---|---|
| InChI | InChI=1S/C12H16O5S2/c1-3-17-11(14)10-7-5-4-6-8(13)9(7)12(18-10)19(2,15)16/h8,13H,3-6H2,1-2H3 |
| InChIKey | MXYDQYSGXYICQK-UHFFFAOYSA-N |
| Mol Weight | 304.38 g/mol |
| Molecular Formula | C12H16O5S2 |
| Exact Mass | 304.043916 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GOFCwTb0i2f |
|---|---|
| Name | 4-hydroxy-3-(methylsulfonyl)-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16O5S2 |
| InChI | InChI=1S/C12H16O5S2/c1-3-17-11(14)10-7-5-4-6-8(13)9(7)12(18-10)19(2,15)16/h8,13H,3-6H2,1-2H3 |
| InChIKey | MXYDQYSGXYICQK-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61256M |
| Solvent | CDCl3 |