| SpectraBase Compound ID | CS3teryOolF |
|---|---|
| InChI | InChI=1S/C16H15N3/c1-11-14(9-17)16(13-7-5-4-6-8-13)15(10-18)12(2)19(11)3/h4-8,16H,1-3H3 |
| InChIKey | AAYDTJDRANEEDE-UHFFFAOYSA-N |
| Mol Weight | 249.32 g/mol |
| Molecular Formula | C16H15N3 |
| Exact Mass | 249.126597 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2l3EVA0wlDm |
|---|---|
| Name | 3,5-Dicyano-1,4-dihydro-1,2,6-trimethyl-4-phenyl-pyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.126597495 u |
| Formula | C16H15N3 |
| InChI | InChI=1S/C16H15N3/c1-11-14(9-17)16(13-7-5-4-6-8-13)15(10-18)12(2)19(11)3/h4-8,16H,1-3H3 |
| InChIKey | AAYDTJDRANEEDE-UHFFFAOYSA-N |
| Molecular Weight | 249.317 g/mol |
| SMILES | C=1(N(C(=C(C(C1C#N)C1=CC=CC=C1)C#N)C)C)C |