| SpectraBase Compound ID | 6zEKmXJLUNi |
|---|---|
| InChI | InChI=1S/C17H13N3O/c1-2-6-13(7-3-1)11-20-12-15(18-19-20)17-10-14-8-4-5-9-16(14)21-17/h1-10,12H,11H2 |
| InChIKey | DHSISIGYESXJEJ-UHFFFAOYSA-N |
| Mol Weight | 275.31 g/mol |
| Molecular Formula | C17H13N3O |
| Exact Mass | 275.105862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ItM9nKo5EdP |
|---|---|
| Name | 4-(Benzofuran-2-yl)-1-benzyl-1H-1,2,3-triazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.105862050 u |
| Formula | C17H13N3O |
| InChI | InChI=1S/C17H13N3O/c1-2-6-13(7-3-1)11-20-12-15(18-19-20)17-10-14-8-4-5-9-16(14)21-17/h1-10,12H,11H2 |
| InChIKey | DHSISIGYESXJEJ-UHFFFAOYSA-N |
| SMILES | C=1(C=2OC3=CC=CC=C3C2)N=NN(C1)CC1=CC=CC=C1 |