| SpectraBase Compound ID | El3v6w8DF1e |
|---|---|
| InChI | InChI=1S/C14H10Cl2N4/c15-10-4-6-12(7-5-10)17-14-18-13(19-20-14)9-2-1-3-11(16)8-9/h1-8H,(H2,17,18,19,20) |
| InChIKey | NEHLMXARFBMBTJ-UHFFFAOYSA-N |
| Mol Weight | 305.17 g/mol |
| Molecular Formula | C14H10Cl2N4 |
| Exact Mass | 304.028252 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CjIdR98mxV5 |
|---|---|
| Name | 5-(3-Chlorophenyl)-N-(4-chlorophenyl)-2H-1,2,4-triazol-3-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.028251738 u |
| Formula | C14H10Cl2N4 |
| InChI | InChI=1S/C14H10Cl2N4/c15-10-4-6-12(7-5-10)17-14-18-13(19-20-14)9-2-1-3-11(16)8-9/h1-8H,(H2,17,18,19,20) |
| InChIKey | NEHLMXARFBMBTJ-UHFFFAOYSA-N |
| Molecular Weight | 305.168 g/mol |
| SMILES | C1(=NC(C2=CC=CC(=C2)Cl)=NN1)NC1=CC=C(C=C1)Cl |