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Phthalic acid, 2-cyclohexylethyl octyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-cyclohexylethyl octyl ester
SpectraBase Compound ID ESb7JQQ6wvv
InChI InChI=1S/C24H36O4/c1-2-3-4-5-6-12-18-27-23(25)21-15-10-11-16-22(21)24(26)28-19-17-20-13-8-7-9-14-20/h10-11,15-16,20H,2-9,12-14,17-19H2,1H3
InChIKey WZJFWUBDDSNESQ-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 2sOAaohHxbJ
Name Phthalic acid, 2-cyclohexylethyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 388.261359635 u
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-2-3-4-5-6-12-18-27-23(25)21-15-10-11-16-22(21)24(26)28-19-17-20-13-8-7-9-14-20/h10-11,15-16,20H,2-9,12-14,17-19H2,1H3
InChIKey WZJFWUBDDSNESQ-UHFFFAOYSA-N
Molecular Weight 388.548 g/mol
SMILES C(OC(=O)C1=CC=CC=C1C(OCCCCCCCC)=O)CC1CCCCC1