| SpectraBase Compound ID | AlvK2JgKZ2p |
|---|---|
| InChI | InChI=1S/C15H16N2O3/c1-19-14-4-2-12(3-5-14)10-13(11-16)15(18)17-6-8-20-9-7-17/h2-5,10H,6-9H2,1H3 |
| InChIKey | BALDQACWJQTHBW-UHFFFAOYSA-N |
| Mol Weight | 272.3 g/mol |
| Molecular Formula | C15H16N2O3 |
| Exact Mass | 272.116092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5n06BRl8FCj |
|---|---|
| Name | alpha-(p-Methoxybenzylidene)-beta-oxo-4-morpholinepropionitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.116092380 u |
| Formula | C15H16N2O3 |
| InChI | InChI=1S/C15H16N2O3/c1-19-14-4-2-12(3-5-14)10-13(11-16)15(18)17-6-8-20-9-7-17/h2-5,10H,6-9H2,1H3 |
| InChIKey | BALDQACWJQTHBW-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=C(C1)OC)C=C(C#N)C(=O)N1CCOCC1 |