| SpectraBase Compound ID | 3oEgXFKGHiu |
|---|---|
| InChI | InChI=1S/C19H22N2O/c1-3-15(2)22-18-11-9-16(10-12-18)19(13-14-20)21-17-7-5-4-6-8-17/h4-12,15,19,21H,3,13H2,1-2H3 |
| InChIKey | QEYMWTXXAKKHER-UHFFFAOYSA-N |
| Mol Weight | 294.4 g/mol |
| Molecular Formula | C19H22N2O |
| Exact Mass | 294.173213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4yPf6esQRGK |
|---|---|
| Name | 3-Anilino-3-(4-but-2-oxyphenyl)propanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.173213335 u |
| Formula | C19H22N2O |
| InChI | InChI=1S/C19H22N2O/c1-3-15(2)22-18-11-9-16(10-12-18)19(13-14-20)21-17-7-5-4-6-8-17/h4-12,15,19,21H,3,13H2,1-2H3 |
| InChIKey | QEYMWTXXAKKHER-UHFFFAOYSA-N |
| SMILES | C(C)(CC)OC1=CC=C(C=C1)C(NC1=CC=CC=C1)CC#N |