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Phthalic acid, 3-(2-methoxyethyl)heptyl propyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 3-(2-methoxyethyl)heptyl propyl ester
SpectraBase Compound ID DJzy4eKhNPr
InChI InChI=1S/C21H32O5/c1-4-6-9-17(12-15-24-3)13-16-26-21(23)19-11-8-7-10-18(19)20(22)25-14-5-2/h7-8,10-11,17H,4-6,9,12-16H2,1-3H3
InChIKey DDCZNUJWSWHSAD-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 3ciDb6ln7rB
Name Phthalic acid, 3-(2-methoxyethyl)heptyl propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 364.224974125 u
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-4-6-9-17(12-15-24-3)13-16-26-21(23)19-11-8-7-10-18(19)20(22)25-14-5-2/h7-8,10-11,17H,4-6,9,12-16H2,1-3H3
InChIKey DDCZNUJWSWHSAD-UHFFFAOYSA-N
Molecular Weight 364.482 g/mol
SMILES C1(=C(C=CC=C1)C(OCCC(CCOC)CCCC)=O)C(OCCC)=O