| SpectraBase Compound ID | 6HBwRiqvwjO |
|---|---|
| InChI | InChI=1S/C17H18N4O/c1-22-16-9-5-8-15(12-16)13-17-18-19-20-21(17)11-10-14-6-3-2-4-7-14/h2-9,12H,10-11,13H2,1H3 |
| InChIKey | LHKWSDLXFXPAHE-UHFFFAOYSA-N |
| Mol Weight | 294.36 g/mol |
| Molecular Formula | C17H18N4O |
| Exact Mass | 294.148061 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DJ16CglI0GX |
|---|---|
| Name | 5-(3-Methoxybenzyl)-1-phenethyl-1H-tetrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.148061215 u |
| Formula | C17H18N4O |
| InChI | InChI=1S/C17H18N4O/c1-22-16-9-5-8-15(12-16)13-17-18-19-20-21(17)11-10-14-6-3-2-4-7-14/h2-9,12H,10-11,13H2,1H3 |
| InChIKey | LHKWSDLXFXPAHE-UHFFFAOYSA-N |
| SMILES | C(C1=CC(=CC=C1)OC)C=1N(CCC2=CC=CC=C2)N=NN1 |