| SpectraBase Spectrum ID |
PS2fAN7l3K |
| Name |
1-Methyl-4-(3,3,3-trifluoropropyl)-1,2,4-triazolium Iodide |
| Alternate Name(s) |
1-methyl-4-(3,3,3-trifluoropropyl)-1,2,4-triazol-4-ium iodide
1-methyl-4-(3,3,3-trifluoropropyl)-4H-1,2,4-triazol-1-ium iodide
1-methyl-4-[3,3,3-tris(fluoranyl)propyl]-1,2,4-triazol-4-ium iodide
1-methyl-4-[3,3,3-tris(fluoranyl)propyl]-1,2,4-triazol-4-ium;iodide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H9F3IN3 |
| InChI |
InChI=1S/C6H9F3N3.HI/c1-11-5-12(4-10-11)3-2-6(7,8)9;/h4-5H,2-3H2,1H3;1H/q+1;/p-1 |
| InChIKey |
DQLKURXZSJUTKA-UHFFFAOYSA-M |
| Molecular Weight |
307.059 g/mol |
| SMILES |
[I-].c1n[n+](c[n]1CCC(F)(F)F)C |
| SPLASH |
splash10-004i-0900000000-b5fdcf2f32a0df3b12c1 |
| Source of Spectrum |
C5-2003-25-2 |
| Wiley ID |
1615233 |
