| SpectraBase Spectrum ID |
5AjFYpyMCL5 |
| Name |
4-(2',4',5'-Trifluorophenyl)-1-methyl-1H-pyrazole-3-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H6F3N3 |
| InChI |
InChI=1S/C11H6F3N3/c1-17-5-7(11(4-15)16-17)6-2-9(13)10(14)3-8(6)12/h2-3,5H,1H3 |
| InChIKey |
BPTINYMQWKOITK-UHFFFAOYSA-N |
| Molecular Weight |
237.185 g/mol |
| SMILES |
c1(c(n[n](c1)C)C#N)-c1c(cc(c(c1)F)F)F |
| SPLASH |
splash10-052r-0090000000-442038b451449dfda0fd |
| Source of Spectrum |
AJ-43-678-7 |
| Synonyms |
1-methyl-4-(2,4,5-trifluorophenyl)-1H-pyrazole-3-carbonitrile
1-methyl-4-(2,4,5-trifluorophenyl)-3-pyrazolecarbonitrile
1-methyl-4-[2,4,5-tris(fluoranyl)phenyl]pyrazole-3-carbonitrile |
| Wiley ID |
1594083 |
