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Glutaric acid, 2,5-dichlorophenyl heptyl ester
SpectraBase Compound ID 1al7UoMfD8h
InChI InChI=1S/C18H24Cl2O4/c1-2-3-4-5-6-12-23-17(21)8-7-9-18(22)24-16-13-14(19)10-11-15(16)20/h10-11,13H,2-9,12H2,1H3
InChIKey LGRVVIUPCJHRFV-UHFFFAOYSA-N
Mol Weight 375.29 g/mol
Molecular Formula C18H24Cl2O4
Exact Mass 374.105165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 28kTLAPa61y
Name Glutaric acid, 2,5-dichlorophenyl heptyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.105164649 u
Formula C18H24Cl2O4
InChI InChI=1S/C18H24Cl2O4/c1-2-3-4-5-6-12-23-17(21)8-7-9-18(22)24-16-13-14(19)10-11-15(16)20/h10-11,13H,2-9,12H2,1H3
InChIKey LGRVVIUPCJHRFV-UHFFFAOYSA-N
Molecular Weight 375.292 g/mol
SMILES CCCCCCCOC(CCCC(OC1=CC(=CC=C1Cl)Cl)=O)=O