| SpectraBase Spectrum ID |
4DI3ZoNnIO |
| Name |
2-Methyl-2-[4-(trifluoromethyl)phenyl]propanal |
| CAS Registry Number |
58254-18-5 |
| Comments |
Note: The molecular formula of the structure shown is C11H11F3O - which differs from the formula reported for the mass spectrum (C11H10DF3O) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H10DF3O |
| InChI |
InChI=1S/C11H11F3O/c1-10(2,7-15)8-3-5-9(6-4-8)11(12,13)14/h3-7H,1-2H3 |
| InChIKey |
LDNRERGPKFITFU-UHFFFAOYSA-N |
| Molecular Weight |
216.203 g/mol |
| SMILES |
c1c(ccc(c1)C(F)(F)F)C(C)(C)C=O |
| SPLASH |
splash10-052u-5900000000-67e8af2a6d54f59ff78a |
| Synonyms |
2-Methyl-2-[4-(trifluoromethyl)phenyl]propionaldehyde |
| Wiley ID |
1489555 |
![2-Methyl-2-[4-(trifluoromethyl)phenyl]propanal](/api/spectrum/4DI3ZoNnIO/structure.png?h=300&w=458 "2-Methyl-2-[4-(trifluoromethyl)phenyl]propanal")
