| SpectraBase Spectrum ID |
KqxNyQLVkSg |
| Name |
3-Methyl-4-trifluoromethyl-5-(4-acetylphenyl)isoxazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H10F3NO2 |
| InChI |
InChI=1S/C13H10F3NO2/c1-7-11(13(14,15)16)12(19-17-7)10-5-3-9(4-6-10)8(2)18/h3-6H,1-2H3 |
| InChIKey |
BPVWEMAQENBDHG-UHFFFAOYSA-N |
| Molecular Weight |
269.223 g/mol |
| SMILES |
c1(noc(c1C(F)(F)F)-c1ccc(cc1)C(=O)C)C |
| SPLASH |
splash10-0udi-0090000000-404309c39fdb5de28f28 |
| Source of Spectrum |
Y1-45-7576-7 |
| Synonyms |
1-{4-[3-methyl-4-(trifluoromethyl)-5-isoxazolyl]phenyl}ethanone |
| Wiley ID |
1622224 |
