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Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-pentyl ester

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Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-pentyl ester
SpectraBase Compound ID 27V68EEug4G
InChI InChI=1S/C14H18F8O4/c1-3-8(4-2)26-10(24)6-5-9(23)25-7-12(17,18)14(21,22)13(19,20)11(15)16/h8,11H,3-7H2,1-2H3
InChIKey GKUOYBJCMBSDRN-UHFFFAOYSA-N
Mol Weight 402.28 g/mol
Molecular Formula C14H18F8O4
Exact Mass 402.107734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ewava5KlFRC
Name Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 402.107734360 u
Formula C14H18F8O4
InChI InChI=1S/C14H18F8O4/c1-3-8(4-2)26-10(24)6-5-9(23)25-7-12(17,18)14(21,22)13(19,20)11(15)16/h8,11H,3-7H2,1-2H3
InChIKey GKUOYBJCMBSDRN-UHFFFAOYSA-N
Molecular Weight 402.281 g/mol
SMILES C(C(C(C(COC(=O)CCC(OC(CC)CC)=O)(F)F)(F)F)(F)F)(F)F