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Phthalic acid, butyl 3-(2-methoxyethyl)octyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Phthalic acid, butyl 3-(2-methoxyethyl)octyl ester
SpectraBase Compound ID 5QNS9eVOant
InChI InChI=1S/C23H36O5/c1-4-6-8-11-19(14-17-26-3)15-18-28-23(25)21-13-10-9-12-20(21)22(24)27-16-7-5-2/h9-10,12-13,19H,4-8,11,14-18H2,1-3H3
InChIKey UAHNBXMDUHVLCE-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID APjC1G7J6ps
Name Phthalic acid, butyl 3-(2-methoxyethyl)octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 392.256274254 u
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-4-6-8-11-19(14-17-26-3)15-18-28-23(25)21-13-10-9-12-20(21)22(24)27-16-7-5-2/h9-10,12-13,19H,4-8,11,14-18H2,1-3H3
InChIKey UAHNBXMDUHVLCE-UHFFFAOYSA-N
Molecular Weight 392.536 g/mol
SMILES C1(=C(C=CC=C1)C(OCCC(CCCCC)CCOC)=O)C(OCCCC)=O