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Phthalic acid, 3,5-dimethylphenyl 4-isopropylphenyl ester

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Phthalic acid, 3,5-dimethylphenyl 4-isopropylphenyl ester
SpectraBase Compound ID 3atib3pAazK
InChI InChI=1S/C25H24O4/c1-16(2)19-9-11-20(12-10-19)28-24(26)22-7-5-6-8-23(22)25(27)29-21-14-17(3)13-18(4)15-21/h5-16H,1-4H3
InChIKey IEERJDGFMULORG-UHFFFAOYSA-N
Mol Weight 388.46 g/mol
Molecular Formula C25H24O4
Exact Mass 388.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2xd9RBuc2I
Name Phthalic acid, 3,5-dimethylphenyl 4-isopropylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.167459249 u
Formula C25H24O4
InChI InChI=1S/C25H24O4/c1-16(2)19-9-11-20(12-10-19)28-24(26)22-7-5-6-8-23(22)25(27)29-21-14-17(3)13-18(4)15-21/h5-16H,1-4H3
InChIKey IEERJDGFMULORG-UHFFFAOYSA-N
Molecular Weight 388.463 g/mol
SMILES C1=C(C=CC(=C1)C(C)C)OC(=O)C1=C(C=CC=C1)C(OC1=CC(C)=CC(C)=C1)=O