SpectraBase Compound ID | 2eTKQf7s92p |
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InChI | InChI=1S/C20H12Cl3NO3S/c21-12-5-8-14(9-6-12)28-20(26)24-19(25)15-3-1-2-4-17(15)27-18-10-7-13(22)11-16(18)23/h1-11H,(H,24,25,26) |
InChIKey | XCUYOKQMCWBLDR-UHFFFAOYSA-N |
Mol Weight | 452.74 g/mol |
Molecular Formula | C20H12Cl3NO3S |
Exact Mass | 450.960348 g/mol |
SpectraBase Spectrum ID | DnPbkv73nuO |
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Name | [o-(2,4-dichlorophenoxy)benzoyl]thiocarbamic acid, S-(p-chlorophenyl)ester |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H12Cl3NO3S |
InChI | InChI=1S/C20H12Cl3NO3S/c21-12-5-8-14(9-6-12)28-20(26)24-19(25)15-3-1-2-4-17(15)27-18-10-7-13(22)11-16(18)23/h1-11H,(H,24,25,26) |
InChIKey | XCUYOKQMCWBLDR-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 46695M |
Solvent | CDCl3 |