| SpectraBase Compound ID | 78JcYLH19pc |
|---|---|
| InChI | InChI=1S/C12H6Cl2N2O5/c13-9-3-2-8(6-10(9)14)21-12-4-1-7(15(17)18)5-11(12)16(19)20/h1-6H |
| InChIKey | MWWQAKDVCAXEIB-UHFFFAOYSA-N |
| Mol Weight | 329.1 g/mol |
| Molecular Formula | C12H6Cl2N2O5 |
| Exact Mass | 327.965377 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FUmH2gFXkAa |
|---|---|
| Name | 3,4-Dichlorophenyl 2,4-dinitrophenyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.965376696 u |
| Formula | C12H6Cl2N2O5 |
| InChI | InChI=1S/C12H6Cl2N2O5/c13-9-3-2-8(6-10(9)14)21-12-4-1-7(15(17)18)5-11(12)16(19)20/h1-6H |
| InChIKey | MWWQAKDVCAXEIB-UHFFFAOYSA-N |
| Molecular Weight | 329.095 g/mol |
| SMILES | C=1C(Cl)=C(Cl)C=CC1OC=1C(=CC(=CC1)N(=O)=O)N(=O)=O |