| SpectraBase Compound ID | 7hxQ0si1BpG |
|---|---|
| InChI | InChI=1S/C20H14ClNO4S/c1-13-2-9-17(10-3-13)27-20(23)14-4-11-19(18(12-14)22(24)25)26-16-7-5-15(21)6-8-16/h2-12H,1H3 |
| InChIKey | KHBJNGKTGJIGLO-UHFFFAOYSA-N |
| Mol Weight | 399.85 g/mol |
| Molecular Formula | C20H14ClNO4S |
| Exact Mass | 399.033207 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 40rUxdeHShe |
|---|---|
| Name | 4-(p-chlorophenoxy)-3-nitrothiobenzoic acid, S-p-toly ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H14ClNO4S |
| InChI | InChI=1S/C20H14ClNO4S/c1-13-2-9-17(10-3-13)27-20(23)14-4-11-19(18(12-14)22(24)25)26-16-7-5-15(21)6-8-16/h2-12H,1H3 |
| InChIKey | KHBJNGKTGJIGLO-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48867M |
| Solvent | CDCl3 |