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3C-fe Prop

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

3C-fe Prop
SpectraBase Compound ID ErVrb3NmFiV
InChI InChI=1S/C16H24FNO4/c1-5-15(19)18-11(2)8-12-9-13(20-3)16(22-7-6-17)14(10-12)21-4/h9-11H,5-8H2,1-4H3,(H,18,19)
InChIKey WVWZZRTWEQCYMX-UHFFFAOYSA-N
Mol Weight 313.37 g/mol
Molecular Formula C16H24FNO4
Exact Mass 313.168936 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9K5AEJV5TV0
Name 3C-fe Prop
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.168936416 u
Formula C16H24FNO4
InChI InChI=1S/C16H24FNO4/c1-5-15(19)18-11(2)8-12-9-13(20-3)16(22-7-6-17)14(10-12)21-4/h9-11H,5-8H2,1-4H3,(H,18,19)
InChIKey WVWZZRTWEQCYMX-UHFFFAOYSA-N
Molecular Weight 313.369 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(NC(CC)=O)C)OC)OCCF
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947675