![4-[5-(3-Methoxyphenyl)-1H-1,2,4-triazol-3-yl]aniline](/api/spectrum/DsXnV2WapEi/structure.png?h=300&w=458 "4-[5-(3-Methoxyphenyl)-1H-1,2,4-triazol-3-yl]aniline")
| SpectraBase Compound ID | JPF9MNcjUfq |
|---|---|
| InChI | InChI=1S/C15H14N4O/c1-20-13-4-2-3-11(9-13)15-17-14(18-19-15)10-5-7-12(16)8-6-10/h2-9H,16H2,1H3,(H,17,18,19) |
| InChIKey | UULNSPQSCFFABT-UHFFFAOYSA-N |
| Mol Weight | 266.3 g/mol |
| Molecular Formula | C15H14N4O |
| Exact Mass | 266.116761 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DsXnV2WapEi |
|---|---|
| Name | 4-[5-(3-Methoxyphenyl)-1H-1,2,4-triazol-3-yl]aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.116761086 u |
| Formula | C15H14N4O |
| InChI | InChI=1S/C15H14N4O/c1-20-13-4-2-3-11(9-13)15-17-14(18-19-15)10-5-7-12(16)8-6-10/h2-9H,16H2,1H3,(H,17,18,19) |
| InChIKey | UULNSPQSCFFABT-UHFFFAOYSA-N |
| Molecular Weight | 266.304 g/mol |
| SMILES | COC1=CC=CC(C=2NN=C(N2)C2=CC=C(C=C2)N)=C1 |