| SpectraBase Compound ID | 1ZHxkPPCKAA |
|---|---|
| InChI | InChI=1S/C19H12Cl3NO2/c20-15-11-17(22)18(12-16(15)21)25-19(24)23(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12H |
| InChIKey | FRZWCDXDXOIWPL-UHFFFAOYSA-N |
| Mol Weight | 392.67 g/mol |
| Molecular Formula | C19H12Cl3NO2 |
| Exact Mass | 390.993362 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Q2PLo9vxr6 |
|---|---|
| Name | N,N-Diphenylcarbamic acid, 2,4,5-trichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 390.993361728 u |
| Formula | C19H12Cl3NO2 |
| InChI | InChI=1S/C19H12Cl3NO2/c20-15-11-17(22)18(12-16(15)21)25-19(24)23(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12H |
| InChIKey | FRZWCDXDXOIWPL-UHFFFAOYSA-N |
| Molecular Weight | 392.669 g/mol |
| SMILES | C1(=CC(Cl)=C(C=C1Cl)OC(N(C1=CC=CC=C1)C1=CC=CC=C1)=O)Cl |