| SpectraBase Compound ID | 799a4ueepUd |
|---|---|
| InChI | InChI=1S/C7H6N2O4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3 |
| InChIKey | XTRDKALNCIHHNI-UHFFFAOYSA-N |
| Mol Weight | 182.13 g/mol |
| Molecular Formula | C7H6N2O4 |
| Exact Mass | 182.032757 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BY4CPAnlRay |
|---|---|
| Name | 2-Methyl-1,3-dinitrobenzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H6N2O4 |
| InChI | InChI=1S/C7H6N2O4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3 |
| InChIKey | XTRDKALNCIHHNI-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 182.135 g/mol |
| SMILES | c1([N+]([O-])=O)cccc(c1C)[N+]([O-])=O |
| SPLASH | splash10-0ik9-9100000000-198ba237d36790a42d8a |
| Source of Spectrum | SRH-2022-1614-0 |
| Synonyms | 2,6-Dinitrotoluene |
| Wiley ID | 1824031 |