| SpectraBase Compound ID | HEAAJX8cWwC |
|---|---|
| InChI | InChI=1S/C6H3ClN2O5/c7-3-1-4(8(11)12)6(10)5(2-3)9(13)14/h1-2,10H |
| InChIKey | KESYALTWUAFAAC-UHFFFAOYSA-N |
| Mol Weight | 218.55 g/mol |
| Molecular Formula | C6H3ClN2O5 |
| Exact Mass | 217.973049 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6Nw9cQBc5cW |
|---|---|
| Name | 4-chloro-2,6-dinitro-phenol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H3ClN2O5 |
| InChI | InChI=1S/C6H3ClN2O5/c7-3-1-4(8(11)12)6(10)5(2-3)9(13)14/h1-2,10H |
| InChIKey | KESYALTWUAFAAC-UHFFFAOYSA-N |
| Molecular Weight | 218.552 g/mol |
| SMILES | Oc1c(N(=O)=O)cc(cc1N(=O)=O)Cl |
| SPLASH | splash10-014i-0090000000-9e1b3fda18bd68960108 |
| Source of Spectrum | F-45-1306-4 |
| Wiley ID | 1216919 |