| SpectraBase Spectrum ID |
LZUEOFc1wQE |
| Name |
4-Chloro-2-nitrophenyl 2,4,5-trichlorophenyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.902353822 u |
| Formula |
C12H5Cl4NO3 |
| InChI |
InChI=1S/C12H5Cl4NO3/c13-6-1-2-11(10(3-6)17(18)19)20-12-5-8(15)7(14)4-9(12)16/h1-5H |
| InChIKey |
LFTQDQJNZDKGTB-UHFFFAOYSA-N |
| Molecular Weight |
352.988 g/mol |
| SMILES |
C=1(Cl)C=C(Cl)C(=CC1OC=1C(=CC(Cl)=CC1)N(=O)=O)Cl |
| Spectrum/Structure Validation Score (Raman) |
0.924932 |
