| SpectraBase Spectrum ID |
FlIWrFHp6jy |
| Name |
4-(2-Chloranyl-6-fluoranyl-phenyl)-8-phenyl-1,3,4,6-tetrahydropyrido[2,3-D]pyridazine-2,5-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.068032532 u |
| Formula |
C19H13ClFN3O2 |
| InChI |
InChI=1S/C19H13ClFN3O2/c20-12-7-4-8-13(21)15(12)11-9-14(25)22-18-16(11)19(26)24-23-17(18)10-5-2-1-3-6-10/h1-8,11H,9H2,(H,22,25)(H,24,26) |
| InChIKey |
JUTBFYAZYMQFEM-UHFFFAOYSA-N |
| Molecular Weight |
369.783 g/mol |
| SMILES |
C12=C(C(C=3C=CC=CC3)=NNC1=O)NC(CC2C=1C(Cl)=CC=CC1F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845194 |
![4-(2-Chloranyl-6-fluoranyl-phenyl)-8-phenyl-1,3,4,6-tetrahydropyrido[2,3-d]pyridazine-2,5-dione](/api/spectrum/FlIWrFHp6jy/structure.png?h=300&w=458 "4-(2-Chloranyl-6-fluoranyl-phenyl)-8-phenyl-1,3,4,6-tetrahydropyrido[2,3-d]pyridazine-2,5-dione")
