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

View entire compound with spectra: 1 NMR

Glutaric acid, 2-methyl-4-chlorophenyl tetradecyl ester
SpectraBase Compound ID B5DNrywKIIp
InChI InChI=1S/C26H41ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-30-25(28)16-15-17-26(29)31-24-19-18-23(27)21-22(24)2/h18-19,21H,3-17,20H2,1-2H3
InChIKey GFEKUYGJNVPYEF-UHFFFAOYSA-N
Mol Weight 453.1 g/mol
Molecular Formula C26H41ClO4
Exact Mass 452.269337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwIM9KQa4Gh
Name Glutaric acid, 2-methyl-4-chlorophenyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 452.269337496 u
Formula C26H41ClO4
InChI InChI=1S/C26H41ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-30-25(28)16-15-17-26(29)31-24-19-18-23(27)21-22(24)2/h18-19,21H,3-17,20H2,1-2H3
InChIKey GFEKUYGJNVPYEF-UHFFFAOYSA-N
Molecular Weight 453.063 g/mol
SMILES CCCCCCCCCCCCCCOC(CCCC(OC1=CC=C(C=C1C)Cl)=O)=O