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Glutaric acid, 2-(3-chlorophenyl)ethyl undecyl ester
SpectraBase Compound ID Lfai7Srfox4
InChI InChI=1S/C24H37ClO4/c1-2-3-4-5-6-7-8-9-10-18-28-23(26)15-12-16-24(27)29-19-17-21-13-11-14-22(25)20-21/h11,13-14,20H,2-10,12,15-19H2,1H3
InChIKey YWOIMJMMLHZELL-UHFFFAOYSA-N
Mol Weight 425.0 g/mol
Molecular Formula C24H37ClO4
Exact Mass 424.238037 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EKiJ8z8FR9T
Name Glutaric acid, 2-(3-chlorophenyl)ethyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 424.238037367 u
Formula C24H37ClO4
InChI InChI=1S/C24H37ClO4/c1-2-3-4-5-6-7-8-9-10-18-28-23(26)15-12-16-24(27)29-19-17-21-13-11-14-22(25)20-21/h11,13-14,20H,2-10,12,15-19H2,1H3
InChIKey YWOIMJMMLHZELL-UHFFFAOYSA-N
Molecular Weight 425.009 g/mol
SMILES C(OCCC1=CC(=CC=C1)Cl)(=O)CCCC(OCCCCCCCCCCC)=O