| SpectraBase Compound ID | J9MCr1QuotF |
|---|---|
| InChI | InChI=1S/C18H20N2O/c19-12-11-18(20-13-16-7-3-1-4-8-16)15-21-14-17-9-5-2-6-10-17/h1-10,18,20H,11,13-15H2 |
| InChIKey | KVZADXYTDRJEOX-UHFFFAOYSA-N |
| Mol Weight | 280.37 g/mol |
| Molecular Formula | C18H20N2O |
| Exact Mass | 280.157563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DeJtYhikr8F |
|---|---|
| Name | 3-Benzylamino-4-benzyloxy-butyronitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.157563271 u |
| Formula | C18H20N2O |
| InChI | InChI=1S/C18H20N2O/c19-12-11-18(20-13-16-7-3-1-4-8-16)15-21-14-17-9-5-2-6-10-17/h1-10,18,20H,11,13-15H2 |
| InChIKey | KVZADXYTDRJEOX-UHFFFAOYSA-N |
| SMILES | C(#N)CC(NCC=1C=CC=CC1)COCC1=CC=CC=C1 |