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4-(Trifluoroacetyl)oxychalcone

View entire compound with spectra: 1 NMR, and 1 FTIR

4-(Trifluoroacetyl)oxychalcone
SpectraBase Compound ID 2RtcF7fnbCN
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
Mol Weight 320.27 g/mol
Molecular Formula C17H11F3O3
Exact Mass 320.066029 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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