![5-(4-Butoxy-phenyl)-2H-[1,2,4]triazol-3-ylamine](/api/spectrum/Md2Aq0JPe9/structure.png?h=300&w=458 "5-(4-Butoxy-phenyl)-2H-[1,2,4]triazol-3-ylamine")
| SpectraBase Compound ID | Er87bKcroym |
|---|---|
| InChI | InChI=1S/C12H16N4O/c1-2-3-8-17-10-6-4-9(5-7-10)11-14-12(13)16-15-11/h4-7H,2-3,8H2,1H3,(H3,13,14,15,16) |
| InChIKey | HSOXFSFLKFLYKW-UHFFFAOYSA-N |
| Mol Weight | 232.29 g/mol |
| Molecular Formula | C12H16N4O |
| Exact Mass | 232.132411 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Md2Aq0JPe9 |
|---|---|
| Name | 5-(4-Butoxy-phenyl)-2H-[1,2,4]triazol-3-ylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.132411150 u |
| Formula | C12H16N4O |
| InChI | InChI=1S/C12H16N4O/c1-2-3-8-17-10-6-4-9(5-7-10)11-14-12(13)16-15-11/h4-7H,2-3,8H2,1H3,(H3,13,14,15,16) |
| InChIKey | HSOXFSFLKFLYKW-UHFFFAOYSA-N |
| Molecular Weight | 232.287 g/mol |
| SMILES | C=1(N=C(NN1)N)C1=CC=C(C=C1)OCCCC |