![5-tert-butyl-3-{[(p-chlorophenyl)sulfonyl]methyl}-2-thiophenecarboxylic acid, methyl ester](/api/spectrum/JKGUlJhKiTl/structure.png?h=300&w=458 "5-tert-butyl-3-{[(p-chlorophenyl)sulfonyl]methyl}-2-thiophenecarboxylic acid, methyl ester")
| SpectraBase Compound ID | FrqVwdPqWmc |
|---|---|
| InChI | InChI=1S/C17H19ClO4S2/c1-17(2,3)14-9-11(15(23-14)16(19)22-4)10-24(20,21)13-7-5-12(18)6-8-13/h5-9H,10H2,1-4H3 |
| InChIKey | HRQYLXSVNNZTOI-UHFFFAOYSA-N |
| Mol Weight | 386.91 g/mol |
| Molecular Formula | C17H19ClO4S2 |
| Exact Mass | 386.041329 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JKGUlJhKiTl |
|---|---|
| Name | 5-tert-butyl-3-{[(p-chlorophenyl)sulfonyl]methyl}-2-thiophenecarboxylic acid, methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H19ClO4S2 |
| InChI | InChI=1S/C17H19ClO4S2/c1-17(2,3)14-9-11(15(23-14)16(19)22-4)10-24(20,21)13-7-5-12(18)6-8-13/h5-9H,10H2,1-4H3 |
| InChIKey | HRQYLXSVNNZTOI-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55834M |
| Solvent | CDCl3 |