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Glutaric acid, 2-ethylhexyl 2-methyl-4-chlorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-ethylhexyl 2-methyl-4-chlorophenyl ester
SpectraBase Compound ID 8wskNzXaH3c
InChI InChI=1S/C20H29ClO4/c1-4-6-8-16(5-2)14-24-19(22)9-7-10-20(23)25-18-12-11-17(21)13-15(18)3/h11-13,16H,4-10,14H2,1-3H3
InChIKey UFFDZVUPMNVKDK-UHFFFAOYSA-N
Mol Weight 368.9 g/mol
Molecular Formula C20H29ClO4
Exact Mass 368.175437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID APBUy7sDBIM
Name Glutaric acid, 2-ethylhexyl 2-methyl-4-chlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 368.175437110 u
Formula C20H29ClO4
InChI InChI=1S/C20H29ClO4/c1-4-6-8-16(5-2)14-24-19(22)9-7-10-20(23)25-18-12-11-17(21)13-15(18)3/h11-13,16H,4-10,14H2,1-3H3
InChIKey UFFDZVUPMNVKDK-UHFFFAOYSA-N
Molecular Weight 368.901 g/mol
SMILES C(CCC(OCC(CC)CCCC)=O)C(OC1=CC=C(C=C1C)Cl)=O