| SpectraBase Spectrum ID |
1OkmdXqothJ |
| Name |
4-(Trifluoroacetyl)oxychalcone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.066028700 u |
| Formula |
C17H11F3O3 |
| InChI |
InChI=1S/C17H11F3O3/c18-17(19,20)16(22)23-14-9-6-12(7-10-14)8-11-15(21)13-4-2-1-3-5-13/h1-11H/b11-8+ |
| InChIKey |
XIAHTJMGSVQQDI-DHZHZOJOSA-N |
| Molecular Weight |
320.267 g/mol |
| SMILES |
C1(=CC=CC=C1)C(\C=C\C=1C=CC(=CC1)OC(C(F)(F)F)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893955 |
