![5-tert-butyl-3-{[(4-chloro-2,5-xylyl)sulfonyl]methyl}-2-thiophenecarboxylic acid, methyl ester](/api/spectrum/JUhcxyyRN1J/structure.png?h=300&w=458 "5-tert-butyl-3-{[(4-chloro-2,5-xylyl)sulfonyl]methyl}-2-thiophenecarboxylic acid, methyl ester")
| SpectraBase Compound ID | 4JYASiw2foK |
|---|---|
| InChI | InChI=1S/C19H23ClO4S2/c1-11-8-15(12(2)7-14(11)20)26(22,23)10-13-9-16(19(3,4)5)25-17(13)18(21)24-6/h7-9H,10H2,1-6H3 |
| InChIKey | YJIXTBHLNMZQHO-UHFFFAOYSA-N |
| Mol Weight | 414.96 g/mol |
| Molecular Formula | C19H23ClO4S2 |
| Exact Mass | 414.072629 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JUhcxyyRN1J |
|---|---|
| Name | 5-tert-butyl-3-{[(4-chloro-2,5-xylyl)sulfonyl]methyl}-2-thiophenecarboxylic acid, methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H23ClO4S2 |
| InChI | InChI=1S/C19H23ClO4S2/c1-11-8-15(12(2)7-14(11)20)26(22,23)10-13-9-16(19(3,4)5)25-17(13)18(21)24-6/h7-9H,10H2,1-6H3 |
| InChIKey | YJIXTBHLNMZQHO-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55835M |
| Solvent | CDCl3 |