| SpectraBase Compound ID | 7dlmNKmbAXv |
|---|---|
| InChI | InChI=1S/C16H14N4O2/c1-22-16-12(8-17)13-11(14(18)20-16)7-10(15(21)19-13)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H2,18,20)(H,19,21) |
| InChIKey | QWWFZMRWYXSPBN-UHFFFAOYSA-N |
| Mol Weight | 294.31 g/mol |
| Molecular Formula | C16H14N4O2 |
| Exact Mass | 294.111676 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | iypSQeiM66 |
|---|---|
| Name | 5-Amino-8-cyano-7-methoxy-3,4-dihydro-3-phenyl-1,6-naphthyridin-2(1H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.111675705 u |
| Formula | C16H14N4O2 |
| InChI | InChI=1S/C16H14N4O2/c1-22-16-12(8-17)13-11(14(18)20-16)7-10(15(21)19-13)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H2,18,20)(H,19,21) |
| InChIKey | QWWFZMRWYXSPBN-UHFFFAOYSA-N |
| SMILES | C12=C(C(N)=NC(=C2C#N)OC)CC(C(N1)=O)C=1C=CC=CC1 |