| SpectraBase Spectrum ID |
1Bu6wdgnei |
| Name |
2-(4-Trifluoromethylphenyl)-4-methylpyrimidine 3-oxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H9F3N2O |
| InChI |
InChI=1S/C12H9F3N2O/c1-8-6-7-16-11(17(8)18)9-2-4-10(5-3-9)12(13,14)15/h2-7H,1H3 |
| InChIKey |
ZTKAAYMISHZKDR-UHFFFAOYSA-N |
| Molecular Weight |
254.212 g/mol |
| SMILES |
c1([n+](c(ccn1)C)[O-])-c1ccc(C(F)(F)F)cc1 |
| SPLASH |
splash10-0udi-3090000000-ece32b13bb1d2bbfbc9a |
| Source of Spectrum |
F-54-4394-5 |
| Synonyms |
6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidine 1-oxide
6-methyl-1-oxidanidyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-1-ium |
| Wiley ID |
806560 |
