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Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester
SpectraBase Compound ID 5j97uWSrRKn
InChI InChI=1S/C24H38F8O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-35-19(33)15-14-16-20(34)36-18-22(27,28)24(31,32)23(29,30)21(25)26/h21H,2-18H2,1H3
InChIKey CCVDONPQMVSWAS-UHFFFAOYSA-N
Mol Weight 542.6 g/mol
Molecular Formula C24H38F8O4
Exact Mass 542.264235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H3euXcJ3F9b
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 542.264235004 u
Formula C24H38F8O4
InChI InChI=1S/C24H38F8O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-35-19(33)15-14-16-20(34)36-18-22(27,28)24(31,32)23(29,30)21(25)26/h21H,2-18H2,1H3
InChIKey CCVDONPQMVSWAS-UHFFFAOYSA-N
Molecular Weight 542.551 g/mol
SMILES CCCCCCCCCCCCCCOC(CCCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)=O