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3C-fp ac

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

3C-fp ac
SpectraBase Compound ID CCfQ2kplljy
InChI InChI=1S/C16H24FNO4/c1-11(18-12(2)19)8-13-9-14(20-3)16(15(10-13)21-4)22-7-5-6-17/h9-11H,5-8H2,1-4H3,(H,18,19)
InChIKey GGFJUAWBVPSGGM-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 3SCBFVOIyKY
Name 3C-fp ac
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/c1-11(18-12(2)19)8-13-9-14(20-3)16(15(10-13)21-4)22-7-5-6-17/h9-11H,5-8H2,1-4H3,(H,18,19)
InChIKey GGFJUAWBVPSGGM-UHFFFAOYSA-N
Molecular Weight 313.369 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(NC(=O)C)C)OC)OCCCF
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968875