| SpectraBase Spectrum ID |
ETjB0wNPH9j |
| Name |
4-(4-Fluoro-phenyl)-7-methyl-2,2-bis-trifluoromethyl-2H-pyrido[1,2-A][1,3,5]triazine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.076294475 u |
| Formula |
C16H10F7N3 |
| InChI |
InChI=1S/C16H10F7N3/c1-9-2-7-12-24-14(15(18,19)20,16(21,22)23)25-13(26(12)8-9)10-3-5-11(17)6-4-10/h2-8H,1H3 |
| InChIKey |
HMRIVVZUQRKUAU-UHFFFAOYSA-N |
| Molecular Weight |
377.266 g/mol |
| SMILES |
C1(N=C(N2C(=N1)C=CC(C)=C2)C1=CC=C(C=C1)F)(C(F)(F)F)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907799 |
![4-(4-Fluoro-phenyl)-7-methyl-2,2-bis-trifluoromethyl-2H-pyrido[1,2-a][1,3,5]triazine](/api/spectrum/ETjB0wNPH9j/structure.png?h=300&w=458 "4-(4-Fluoro-phenyl)-7-methyl-2,2-bis-trifluoromethyl-2H-pyrido[1,2-a][1,3,5]triazine")
