![4-[(p-chlorophenyl)sulfonyl]-3-methylthio-2-thiophenecarbamic acid, S-(4-chloro-2,5-xylyl)ester](/api/spectrum/7R24k9P0xAs/structure.png?h=300&w=458 "4-[(p-chlorophenyl)sulfonyl]-3-methylthio-2-thiophenecarbamic acid, S-(4-chloro-2,5-xylyl)ester")
| SpectraBase Compound ID | 91wLxl3tG0G |
|---|---|
| InChI | InChI=1S/C20H17Cl2NO3S3/c1-11-9-17(12(2)8-16(11)22)28-20(24)23-19-13(3)18(10-27-19)29(25,26)15-6-4-14(21)5-7-15/h4-10H,1-3H3,(H,23,24) |
| InChIKey | ZENUJIUCWLXCPQ-UHFFFAOYSA-N |
| Mol Weight | 486.45 g/mol |
| Molecular Formula | C20H17Cl2NO3S3 |
| Exact Mass | 484.974762 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7R24k9P0xAs |
|---|---|
| Name | 4-[(p-chlorophenyl)sulfonyl]-3-methylthio-2-thiophenecarbamic acid, S-(4-chloro-2,5-xylyl)ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H17Cl2NO3S3 |
| InChI | InChI=1S/C20H17Cl2NO3S3/c1-11-9-17(12(2)8-16(11)22)28-20(24)23-19-13(3)18(10-27-19)29(25,26)15-6-4-14(21)5-7-15/h4-10H,1-3H3,(H,23,24) |
| InChIKey | ZENUJIUCWLXCPQ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48587M |
| Solvent | CDCl3 |