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Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester

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

Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester
SpectraBase Compound ID 6ZQmyHWQVAF
InChI InChI=1S/C14H8F10O4/c15-11(16,13(19,20)21)9(25)27-6-8(7-4-2-1-3-5-7)28-10(26)12(17,18)14(22,23)24/h1-5,8H,6H2
InChIKey RDPUGQNOTAYRPE-UHFFFAOYSA-N
Mol Weight 430.2 g/mol
Molecular Formula C14H8F10O4
Exact Mass 430.02629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID El5GAbdtWZv
Name Propanoic acid, pentafluoro-, 1-phenyl-1,2-ethanediyl ester
Comments Computed using HOSE algorithm
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Exact Mass 430.026290364 u
Formula C14H8F10O4
InChI InChI=1S/C14H8F10O4/c15-11(16,13(19,20)21)9(25)27-6-8(7-4-2-1-3-5-7)28-10(26)12(17,18)14(22,23)24/h1-5,8H,6H2
InChIKey RDPUGQNOTAYRPE-UHFFFAOYSA-N
Molecular Weight 430.198 g/mol
SMILES C(OC(C(C(F)(F)F)(F)F)=O)(COC(C(C(F)(F)F)(F)F)=O)C1=CC=CC=C1