| SpectraBase Compound ID | 5XvVSuL9hs7 |
|---|---|
| InChI | InChI=1S/C8H6N4O2/c13-12(14)7-3-1-6(2-4-7)8-5-9-11-10-8/h1-5H,(H,9,10,11) |
| InChIKey | HXIHDBOLXXRPOZ-UHFFFAOYSA-N |
| Mol Weight | 190.16 g/mol |
| Molecular Formula | C8H6N4O2 |
| Exact Mass | 190.049075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GOsPfvzpIPu |
|---|---|
| Name | 1H-1,2,3-Triazole, 4-(4-nitrophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.049075447 u |
| Formula | C8H6N4O2 |
| InChI | InChI=1S/C8H6N4O2/c13-12(14)7-3-1-6(2-4-7)8-5-9-11-10-8/h1-5H,(H,9,10,11) |
| InChIKey | HXIHDBOLXXRPOZ-UHFFFAOYSA-N |
| Molecular Weight | 190.162 g/mol |
| SMILES | C1(=CC=C(C=C1)C1=CNN=N1)N(=O)=O |