![benzo[b]thiophene-2-carboxylic acid, 4-[(p-chlorophenyl)sulfonyl]-2-nitrophenyl ester](/api/spectrum/7roLsOCAJf/structure.png?h=300&w=458 "benzo[b]thiophene-2-carboxylic acid, 4-[(p-chlorophenyl)sulfonyl]-2-nitrophenyl ester")
| SpectraBase Compound ID | 7TzQAn4EyGu |
|---|---|
| InChI | InChI=1S/C21H12ClNO6S2/c22-14-5-7-15(8-6-14)31(27,28)16-9-10-18(17(12-16)23(25)26)29-21(24)20-11-13-3-1-2-4-19(13)30-20/h1-12H |
| InChIKey | OPYBQPPVIIBAEI-UHFFFAOYSA-N |
| Mol Weight | 473.9 g/mol |
| Molecular Formula | C21H12ClNO6S2 |
| Exact Mass | 472.979457 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7roLsOCAJf |
|---|---|
| Name | benzo[b]thiophene-2-carboxylic acid, 4-[(p-chlorophenyl)sulfonyl]-2-nitrophenyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H12ClNO6S2 |
| InChI | InChI=1S/C21H12ClNO6S2/c22-14-5-7-15(8-6-14)31(27,28)16-9-10-18(17(12-16)23(25)26)29-21(24)20-11-13-3-1-2-4-19(13)30-20/h1-12H |
| InChIKey | OPYBQPPVIIBAEI-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56247M |
| Solvent | Polysol |