| SpectraBase Spectrum ID |
9ENz5ozhKJN |
| Name |
3-(3-Ethylphenyl)-2-methylquinazolin-4(3H)-one hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.102940874 u |
| Formula |
C17H17ClN2O |
| InChI |
InChI=1S/C17H16N2O.ClH/c1-3-13-7-6-8-14(11-13)19-12(2)18-16-10-5-4-9-15(16)17(19)20;/h4-11H,3H2,1-2H3;1H |
| InChIKey |
FVJRCUHSTBBOKB-UHFFFAOYSA-N |
| Molecular Weight |
300.789 g/mol |
| SMILES |
Cl.C1=CC=C2C(N(C(=NC2=C1)C)C=1C=CC=C(C1)CC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.965639 |
