| SpectraBase Compound ID | 3rC1JqmfEeZ |
|---|---|
| InChI | InChI=1S/C14H10ClN3/c15-10-4-3-5-11(8-10)18-14-12-6-1-2-7-13(12)16-9-17-14/h1-9H,(H,16,17,18) |
| InChIKey | ZKKVUIPXPPDIRD-UHFFFAOYSA-N |
| Mol Weight | 255.71 g/mol |
| Molecular Formula | C14H10ClN3 |
| Exact Mass | 255.056325 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6SJ0M2YOMC0 |
|---|---|
| Name | N-(3-Chlorophenyl)-4-quinazolinamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.056325034 u |
| Formula | C14H10ClN3 |
| InChI | InChI=1S/C14H10ClN3/c15-10-4-3-5-11(8-10)18-14-12-6-1-2-7-13(12)16-9-17-14/h1-9H,(H,16,17,18) |
| InChIKey | ZKKVUIPXPPDIRD-UHFFFAOYSA-N |
| Molecular Weight | 255.708 g/mol |
| SMILES | C1(Cl)=CC(=CC=C1)NC1=NC=NC=2C1=CC=CC2 |