![5-(4-Propoxy-phenyl)-1H-[1,2,4]triazol-3-ylamine](/api/spectrum/6ZRip3mkNIy/structure.png?h=300&w=458 "5-(4-Propoxy-phenyl)-1H-[1,2,4]triazol-3-ylamine")
| SpectraBase Compound ID | ITfOPudf9aO |
|---|---|
| InChI | InChI=1S/C11H14N4O/c1-2-7-16-9-5-3-8(4-6-9)10-13-11(12)15-14-10/h3-6H,2,7H2,1H3,(H3,12,13,14,15) |
| InChIKey | YONXRUXHQVNHHE-UHFFFAOYSA-N |
| Mol Weight | 218.26 g/mol |
| Molecular Formula | C11H14N4O |
| Exact Mass | 218.116761 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ZRip3mkNIy |
|---|---|
| Name | 5-(4-Propoxy-phenyl)-1H-[1,2,4]triazol-3-ylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.116761086 u |
| Formula | C11H14N4O |
| InChI | InChI=1S/C11H14N4O/c1-2-7-16-9-5-3-8(4-6-9)10-13-11(12)15-14-10/h3-6H,2,7H2,1H3,(H3,12,13,14,15) |
| InChIKey | YONXRUXHQVNHHE-UHFFFAOYSA-N |
| Molecular Weight | 218.260 g/mol |
| SMILES | C1(=NC(=NN1)N)C1=CC=C(C=C1)OCCC |