| SpectraBase Compound ID | LIcXiCvHMS8 |
|---|---|
| InChI | InChI=1S/C9H7N5O4/c1-6-4-7(13(15)16)9(8(5-6)14(17)18)12-10-2-3-11-12/h2-5H,1H3 |
| InChIKey | YUUZHWMWVJNPOB-UHFFFAOYSA-N |
| Mol Weight | 249.19 g/mol |
| Molecular Formula | C9H7N5O4 |
| Exact Mass | 249.049804 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3NCQIaTJ35x |
|---|---|
| Name | 2-(4-Methyl-2,6-dinitrophenyl)-2H-1,2,3-triazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7N5O4 |
| InChI | InChI=1S/C9H7N5O4/c1-6-4-7(13(15)16)9(8(5-6)14(17)18)12-10-2-3-11-12/h2-5H,1H3 |
| InChIKey | YUUZHWMWVJNPOB-UHFFFAOYSA-N |
| Molecular Weight | 249.186 g/mol |
| SMILES | c1n[n](nc1)-c1c(cc(cc1[N+](=O)[O-])C)[N+](=O)[O-] |
| SPLASH | splash10-0udi-0090000000-9c2b864148673323f588 |
| Source of Spectrum | AJO-5-138/SM8-4b |
| Wiley ID | 1798789 |