![[o-(2,4-dichlorophenoxy)benzoyl]thiocarbamic acid, S-(2-chloro-6-fluorobenzyl)ester](/api/spectrum/4Fct1JxUyPX/structure.png?h=300&w=458 "[o-(2,4-dichlorophenoxy)benzoyl]thiocarbamic acid, S-(2-chloro-6-fluorobenzyl)ester")
| SpectraBase Compound ID | 3jYE70WkQAW |
|---|---|
| InChI | InChI=1S/C21H13Cl3FNO3S/c22-12-8-9-19(16(24)10-12)29-18-7-2-1-4-13(18)20(27)26-21(28)30-11-14-15(23)5-3-6-17(14)25/h1-10H,11H2,(H,26,27,28) |
| InChIKey | JAJYZXMJTGPCIM-UHFFFAOYSA-N |
| Mol Weight | 484.76 g/mol |
| Molecular Formula | C21H13Cl3FNO3S |
| Exact Mass | 482.966576 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Fct1JxUyPX |
|---|---|
| Name | [o-(2,4-dichlorophenoxy)benzoyl]thiocarbamic acid, S-(2-chloro-6-fluorobenzyl)ester |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H13Cl3FNO3S |
| InChI | InChI=1S/C21H13Cl3FNO3S/c22-12-8-9-19(16(24)10-12)29-18-7-2-1-4-13(18)20(27)26-21(28)30-11-14-15(23)5-3-6-17(14)25/h1-10H,11H2,(H,26,27,28) |
| InChIKey | JAJYZXMJTGPCIM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 46696M |
| Solvent | CDCl3 |