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Succinic acid, 2-methylhex-3-yl 2-(pentafluorophenoxy)ethyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 2-methylhex-3-yl 2-(pentafluorophenoxy)ethyl ester
SpectraBase Compound ID 6Y6LfDh2qmO
InChI InChI=1S/C19H23F5O5/c1-4-5-11(10(2)3)29-13(26)7-6-12(25)27-8-9-28-19-17(23)15(21)14(20)16(22)18(19)24/h10-11H,4-9H2,1-3H3
InChIKey WVAIWHMUHADCMX-UHFFFAOYSA-N
Mol Weight 426.38 g/mol
Molecular Formula C19H23F5O5
Exact Mass 426.146565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJEl1F6IXIr
Name Succinic acid, 2-methylhex-3-yl 2-(pentafluorophenoxy)ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 426.146564651 u
Formula C19H23F5O5
InChI InChI=1S/C19H23F5O5/c1-4-5-11(10(2)3)29-13(26)7-6-12(25)27-8-9-28-19-17(23)15(21)14(20)16(22)18(19)24/h10-11H,4-9H2,1-3H3
InChIKey WVAIWHMUHADCMX-UHFFFAOYSA-N
Molecular Weight 426.380 g/mol
SMILES C(CCC(OCCOC1=C(C(=C(C(=C1F)F)F)F)F)=O)(OC(CCC)C(C)C)=O