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Phthalic acid, 2-ethylcyclohexyl octyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-ethylcyclohexyl octyl ester
SpectraBase Compound ID KjLltxUQww2
InChI InChI=1S/C24H36O4/c1-3-5-6-7-8-13-18-27-23(25)20-15-10-11-16-21(20)24(26)28-22-17-12-9-14-19(22)4-2/h10-11,15-16,19,22H,3-9,12-14,17-18H2,1-2H3
InChIKey UEKNIMYQNYYTEA-UHFFFAOYSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6ubhZVq6Iy
Name Phthalic acid, 2-ethylcyclohexyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 388.261359635 u
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-3-5-6-7-8-13-18-27-23(25)20-15-10-11-16-21(20)24(26)28-22-17-12-9-14-19(22)4-2/h10-11,15-16,19,22H,3-9,12-14,17-18H2,1-2H3
InChIKey UEKNIMYQNYYTEA-UHFFFAOYSA-N
Molecular Weight 388.548 g/mol
SMILES C(OC1C(CCCC1)CC)(=O)C1=C(C=CC=C1)C(OCCCCCCCC)=O