| SpectraBase Spectrum ID |
E5NaZUvVDcV |
| Name |
2-(Benzylamino)-3-(2,4-dibromophenyl)-3H-quinazolin-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
482.958188114 u |
| Formula |
C21H15Br2N3O |
| InChI |
InChI=1S/C21H15Br2N3O/c22-15-10-11-19(17(23)12-15)26-20(27)16-8-4-5-9-18(16)25-21(26)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,24,25) |
| InChIKey |
IODYFQYKWPDSNY-UHFFFAOYSA-N |
| Molecular Weight |
485.179 g/mol |
| SMILES |
C=1(N(C(C2=C(N1)C=CC=C2)=O)C=1C(=CC(=CC1)Br)Br)NCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928963 |
