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Phthalic acid, di(2-isopropoxyphenyl) ester

View entire compound with spectra: 1 NMR

Phthalic acid, di(2-isopropoxyphenyl) ester
SpectraBase Compound ID 3eCSrP8Z4eL
InChI InChI=1S/C26H26O6/c1-17(2)29-21-13-7-9-15-23(21)31-25(27)19-11-5-6-12-20(19)26(28)32-24-16-10-8-14-22(24)30-18(3)4/h5-18H,1-4H3
InChIKey JJVHKOCYUIAFIQ-UHFFFAOYSA-N
Mol Weight 434.49 g/mol
Molecular Formula C26H26O6
Exact Mass 434.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hff7vejFWz
Name Phthalic acid, di(2-isopropoxyphenyl) ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.172938551 u
Formula C26H26O6
InChI InChI=1S/C26H26O6/c1-17(2)29-21-13-7-9-15-23(21)31-25(27)19-11-5-6-12-20(19)26(28)32-24-16-10-8-14-22(24)30-18(3)4/h5-18H,1-4H3
InChIKey JJVHKOCYUIAFIQ-UHFFFAOYSA-N
Molecular Weight 434.488 g/mol
SMILES C(C1=C(C(OC2=C(C=CC=C2)OC(C)C)=O)C=CC=C1)(OC1=C(C=CC=C1)OC(C)C)=O