| SpectraBase Spectrum ID |
Ia5phvgJNeO |
| Name |
3-Phenyl-3-[4-(trifluoromethyl)phenyl]chroman-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.102414210 u |
| Formula |
C22H15F3O2 |
| InChI |
InChI=1S/C22H15F3O2/c23-22(24,25)17-12-10-16(11-13-17)21(15-6-2-1-3-7-15)14-27-19-9-5-4-8-18(19)20(21)26/h1-13H,14H2 |
| InChIKey |
HILBUYMOFBDGQK-UHFFFAOYSA-N |
| Molecular Weight |
368.355 g/mol |
| SMILES |
C1(C(COC2=C1C=CC=C2)(C=1C=CC(C(F)(F)F)=CC1)C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946302 |
![3-Phenyl-3-[4-(trifluoromethyl)phenyl]chroman-4-one](/api/spectrum/Ia5phvgJNeO/structure.png?h=300&w=458 "3-Phenyl-3-[4-(trifluoromethyl)phenyl]chroman-4-one")
