| SpectraBase Compound ID | 8UlZNXe4cHR |
|---|---|
| InChI | InChI=1S/C15H12ClN3/c16-12-7-5-11(6-8-12)9-17-15-13-3-1-2-4-14(13)18-10-19-15/h1-8,10H,9H2,(H,17,18,19) |
| InChIKey | BTRLSAYDVSPYCS-UHFFFAOYSA-N |
| Mol Weight | 269.73 g/mol |
| Molecular Formula | C15H12ClN3 |
| Exact Mass | 269.071975 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCULAAL2qHC |
|---|---|
| Name | N-(4-Chlorobenzyl)-4-quinazolinamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.071975098 u |
| Formula | C15H12ClN3 |
| InChI | InChI=1S/C15H12ClN3/c16-12-7-5-11(6-8-12)9-17-15-13-3-1-2-4-14(13)18-10-19-15/h1-8,10H,9H2,(H,17,18,19) |
| InChIKey | BTRLSAYDVSPYCS-UHFFFAOYSA-N |
| Molecular Weight | 269.735 g/mol |
| SMILES | C1(Cl)=CC=C(C=C1)CNC1=NC=NC=2C1=CC=CC2 |