![1-[4-(4-Quinazolinylamino)phenyl]ethanone](/api/spectrum/9E7mL9RmyNj/structure.png?h=300&w=458 "1-[4-(4-Quinazolinylamino)phenyl]ethanone")
| SpectraBase Compound ID | 1a33WKbL4mE |
|---|---|
| InChI | InChI=1S/C16H13N3O/c1-11(20)12-6-8-13(9-7-12)19-16-14-4-2-3-5-15(14)17-10-18-16/h2-10H,1H3,(H,17,18,19) |
| InChIKey | WNKZUHZLTQWSNI-UHFFFAOYSA-N |
| Mol Weight | 263.3 g/mol |
| Molecular Formula | C16H13N3O |
| Exact Mass | 263.105862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9E7mL9RmyNj |
|---|---|
| Name | 1-[4-(4-Quinazolinylamino)phenyl]ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.105862050 u |
| Formula | C16H13N3O |
| InChI | InChI=1S/C16H13N3O/c1-11(20)12-6-8-13(9-7-12)19-16-14-4-2-3-5-15(14)17-10-18-16/h2-10H,1H3,(H,17,18,19) |
| InChIKey | WNKZUHZLTQWSNI-UHFFFAOYSA-N |
| Molecular Weight | 263.300 g/mol |
| SMILES | C(C)(=O)C1=CC=C(C=C1)NC=1C=2C(N=CN1)=CC=CC2 |