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Pyrazolidine-3,5-dione, 4-(4-fluorobenzylidene)-1-phenyl-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Pyrazolidine-3,5-dione, 4-(4-fluorobenzylidene)-1-phenyl-
SpectraBase Compound ID 1578FEqRRHI
InChI InChI=1S/C16H11FN2O2/c17-12-8-6-11(7-9-12)10-14-15(20)18-19(16(14)21)13-4-2-1-3-5-13/h1-10H,(H,18,20)/b14-10+
InChIKey OANYBHUUBYIOSA-GXDHUFHOSA-N
Mol Weight 282.27 g/mol
Molecular Formula C16H11FN2O2
Exact Mass 282.080456 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B2wPhBjOlmZ
Name Pyrazolidine-3,5-dione, 4-(4-fluorobenzylidene)-1-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.080455763 u
Formula C16H11FN2O2
InChI InChI=1S/C16H11FN2O2/c17-12-8-6-11(7-9-12)10-14-15(20)18-19(16(14)21)13-4-2-1-3-5-13/h1-10H,(H,18,20)/b14-10+
InChIKey OANYBHUUBYIOSA-GXDHUFHOSA-N
Molecular Weight 282.274 g/mol
SMILES C1(\C(C(NN1C1=CC=CC=C1)=O)=C\C1=CC=C(C=C1)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812525