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Phthalic acid, di(2-(pentafluorophenoxy)ethyl) ester

View entire compound with spectra: 1 NMR

Phthalic acid, di(2-(pentafluorophenoxy)ethyl) ester
SpectraBase Compound ID LDMA2uQFYU1
InChI InChI=1S/C24H12F10O6/c25-11-13(27)17(31)21(18(32)14(11)28)37-5-7-39-23(35)9-3-1-2-4-10(9)24(36)40-8-6-38-22-19(33)15(29)12(26)16(30)20(22)34/h1-4H,5-8H2
InChIKey YRRDCMQPZRIEHU-UHFFFAOYSA-N
Mol Weight 586.34 g/mol
Molecular Formula C24H12F10O6
Exact Mass 586.04742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9qTrsT8Axd1
Name Phthalic acid, di(2-(pentafluorophenoxy)ethyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 586.047419730 u
Formula C24H12F10O6
InChI InChI=1S/C24H12F10O6/c25-11-13(27)17(31)21(18(32)14(11)28)37-5-7-39-23(35)9-3-1-2-4-10(9)24(36)40-8-6-38-22-19(33)15(29)12(26)16(30)20(22)34/h1-4H,5-8H2
InChIKey YRRDCMQPZRIEHU-UHFFFAOYSA-N
Molecular Weight 586.338 g/mol
SMILES C(C1=CC=CC=C1C(OCCOC1=C(C(=C(C(=C1F)F)F)F)F)=O)(OCCOC1=C(C(=C(C(=C1F)F)F)F)F)=O