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Glutaric acid, 2-(2,4-dichlorophenyl)ethyl heptyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-(2,4-dichlorophenyl)ethyl heptyl ester
SpectraBase Compound ID 3c29haQhK1R
InChI InChI=1S/C20H28Cl2O4/c1-2-3-4-5-6-13-25-19(23)8-7-9-20(24)26-14-12-16-10-11-17(21)15-18(16)22/h10-11,15H,2-9,12-14H2,1H3
InChIKey BFAWPIPPSZZLAK-UHFFFAOYSA-N
Mol Weight 403.35 g/mol
Molecular Formula C20H28Cl2O4
Exact Mass 402.136465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2CEHZkbiK5Z
Name Glutaric acid, 2-(2,4-dichlorophenyl)ethyl heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 402.136464778 u
Formula C20H28Cl2O4
InChI InChI=1S/C20H28Cl2O4/c1-2-3-4-5-6-13-25-19(23)8-7-9-20(24)26-14-12-16-10-11-17(21)15-18(16)22/h10-11,15H,2-9,12-14H2,1H3
InChIKey BFAWPIPPSZZLAK-UHFFFAOYSA-N
Molecular Weight 403.346 g/mol
SMILES C(OCCC1=CC=C(C=C1Cl)Cl)(=O)CCCC(OCCCCCCC)=O