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1,1,1,5,5,6,7,7,7-Nonafluoroheptane-2,4-dione
SpectraBase Compound ID 69hYiJTxXbD
InChI InChI=1S/C7H3F9O2/c8-4(7(14,15)16)5(9,10)2(17)1-3(18)6(11,12)13/h4H,1H2
InChIKey OCQSZEZZZKYJSC-UHFFFAOYSA-N
Mol Weight 290.08 g/mol
Molecular Formula C7H3F9O2
Exact Mass 289.998933 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GpoN6OcNEfq
Name 1,1,1,5,5,6,7,7,7-Nonafluoroheptane-2,4-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.998932802 u
Formula C7H3F9O2
InChI InChI=1S/C7H3F9O2/c8-4(7(14,15)16)5(9,10)2(17)1-3(18)6(11,12)13/h4H,1H2
InChIKey OCQSZEZZZKYJSC-UHFFFAOYSA-N
Molecular Weight 290.085 g/mol
SMILES C(CC(C(F)(F)F)=O)(C(F)(F)C(C(F)(F)F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96919