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

View entire compound with spectra: 1 NMR

Phthalic acid, ethyl 3-(2-methoxyethyl)octyl ester
SpectraBase Compound ID G3I4BcgBlLb
InChI InChI=1S/C21H32O5/c1-4-6-7-10-17(13-15-24-3)14-16-26-21(23)19-12-9-8-11-18(19)20(22)25-5-2/h8-9,11-12,17H,4-7,10,13-16H2,1-3H3
InChIKey XULDEDKCQNBBIV-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kSaK0yiSJ7
Name Phthalic acid, ethyl 3-(2-methoxyethyl)octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 364.224974125 u
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-4-6-7-10-17(13-15-24-3)14-16-26-21(23)19-12-9-8-11-18(19)20(22)25-5-2/h8-9,11-12,17H,4-7,10,13-16H2,1-3H3
InChIKey XULDEDKCQNBBIV-UHFFFAOYSA-N
Molecular Weight 364.482 g/mol
SMILES C1(=C(C=CC=C1)C(OCCC(CCCCC)CCOC)=O)C(OCC)=O