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Perfluorononanoic acid dmbs

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Perfluorononanoic acid dmbs
SpectraBase Compound ID 5m7OPU7DwAR
InChI InChI=1S/C15H15F17O2Si/c1-7(2,3)35(4,5)34-6(33)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)14(28,29)15(30,31)32/h1-5H3
InChIKey KKCCTSBSWPWIIL-UHFFFAOYSA-N
Mol Weight 578.34 g/mol
Molecular Formula C15H15F17O2Si
Exact Mass 578.056985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EMsMr6PlrJh
Name Perfluorononanoic acid dmbs
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 578.056985027 u
Formula C15H15F17O2Si
InChI InChI=1S/C15H15F17O2Si/c1-7(2,3)35(4,5)34-6(33)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)14(28,29)15(30,31)32/h1-5H3
InChIKey KKCCTSBSWPWIIL-UHFFFAOYSA-N
Molecular Weight 578.341 g/mol
SMILES C(C(C(C(C(O[Si](C(C)(C)C)(C)C)=O)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F