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1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl pentyl ester

View entire compound with spectra: 1 NMR

1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl pentyl ester
SpectraBase Compound ID 5H5SNvuC8Ge
InChI InChI=1S/C19H24Cl2O4/c1-2-3-6-11-24-18(22)14-7-4-5-8-15(14)19(23)25-17-12-13(20)9-10-16(17)21/h9-10,12,14-15H,2-8,11H2,1H3
InChIKey GSZDMKNQACOUOZ-UHFFFAOYSA-N
Mol Weight 387.3 g/mol
Molecular Formula C19H24Cl2O4
Exact Mass 386.105165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Rbgt7w6Sw0
Name 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 386.105164649 u
Formula C19H24Cl2O4
InChI InChI=1S/C19H24Cl2O4/c1-2-3-6-11-24-18(22)14-7-4-5-8-15(14)19(23)25-17-12-13(20)9-10-16(17)21/h9-10,12,14-15H,2-8,11H2,1H3
InChIKey GSZDMKNQACOUOZ-UHFFFAOYSA-N
Molecular Weight 387.303 g/mol
SMILES C(C1CCCCC1C(OCCCCC)=O)(=O)OC1=CC(=CC=C1Cl)Cl