| SpectraBase Compound ID | B8GNQLSLIqg |
|---|---|
| InChI | InChI=1S/C9H10N4/c1-6-4-2-3-5-7(6)8-11-9(10)13-12-8/h2-5H,1H3,(H3,10,11,12,13) |
| InChIKey | JTVXXFOZWWQLPB-UHFFFAOYSA-N |
| Mol Weight | 174.21 g/mol |
| Molecular Formula | C9H10N4 |
| Exact Mass | 174.090546 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2u97sB4Y27J |
|---|---|
| Name | 5-(2-Methylphenyl)-1H-1,2,4-triazol-3-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.090546338 u |
| Formula | C9H10N4 |
| InChI | InChI=1S/C9H10N4/c1-6-4-2-3-5-7(6)8-11-9(10)13-12-8/h2-5H,1H3,(H3,10,11,12,13) |
| InChIKey | JTVXXFOZWWQLPB-UHFFFAOYSA-N |
| Molecular Weight | 174.207 g/mol |
| SMILES | C=1C=CC(C=2NC(=NN2)N)=C(C)C1 |