| SpectraBase Compound ID | 7pDW6mtzlR |
|---|---|
| InChI | InChI=1S/C15H15N3/c1-12-2-4-14(5-3-12)18-15(6-9-16)13-7-10-17-11-8-13/h2-5,7-8,10-11,15,18H,6H2,1H3 |
| InChIKey | OLLXUAGHHYJULF-UHFFFAOYSA-N |
| Mol Weight | 237.31 g/mol |
| Molecular Formula | C15H15N3 |
| Exact Mass | 237.126597 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GJ2zIBqMak5 |
|---|---|
| Name | 3-(4'-Methylanilino)-3-(4""""-pyridyl)propionitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.126597495 u |
| Formula | C15H15N3 |
| InChI | InChI=1S/C15H15N3/c1-12-2-4-14(5-3-12)18-15(6-9-16)13-7-10-17-11-8-13/h2-5,7-8,10-11,15,18H,6H2,1H3 |
| InChIKey | OLLXUAGHHYJULF-UHFFFAOYSA-N |
| Molecular Weight | 237.306 g/mol |
| SMILES | C(#N)CC(NC=1C=CC(=CC1)C)C=1C=CN=CC1 |