![N-[(E)-(4-methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine](/api/spectrum/7OXeCO7wMxl/structure.png?h=300&w=458 "N-[(E)-(4-methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine")
| SpectraBase Compound ID | EU1rC9WAOcR |
|---|---|
| InChI | InChI=1S/C10H10N4/c1-9-2-4-10(5-3-9)6-13-14-7-11-12-8-14/h2-8H,1H3/b13-6+ |
| InChIKey | LDUDOXLNNOIDQQ-AWNIVKPZSA-N |
| Mol Weight | 186.22 g/mol |
| Molecular Formula | C10H10N4 |
| Exact Mass | 186.090546 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7OXeCO7wMxl |
|---|---|
| Name | N-[(E)-(4-Methylphenyl)methylidene]-4H-1,2,4-triazol-4-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.090546338 u |
| Formula | C10H10N4 |
| InChI | InChI=1S/C10H10N4/c1-9-2-4-10(5-3-9)6-13-14-7-11-12-8-14/h2-8H,1H3/b13-6+ |
| InChIKey | LDUDOXLNNOIDQQ-AWNIVKPZSA-N |
| Molecular Weight | 186.218 g/mol |
| SMILES | CC=1C=CC(\C=N\N2C=NN=C2)=CC1 |