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Adipic acid, di(2-isopropylphenyl) ester

View entire compound with spectra: 1 NMR

Adipic acid, di(2-isopropylphenyl) ester
SpectraBase Compound ID Jj1g00OQxY4
InChI InChI=1S/C24H30O4/c1-17(2)19-11-5-7-13-21(19)27-23(25)15-9-10-16-24(26)28-22-14-8-6-12-20(22)18(3)4/h5-8,11-14,17-18H,9-10,15-16H2,1-4H3
InChIKey MZFHGKTWIXHSHK-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KHnkIZiBDC
Name Adipic acid, di(2-isopropylphenyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 382.214409442 u
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-17(2)19-11-5-7-13-21(19)27-23(25)15-9-10-16-24(26)28-22-14-8-6-12-20(22)18(3)4/h5-8,11-14,17-18H,9-10,15-16H2,1-4H3
InChIKey MZFHGKTWIXHSHK-UHFFFAOYSA-N
Molecular Weight 382.500 g/mol
SMILES C(C(=O)OC1=C(C=CC=C1)C(C)C)CCCC(OC=1C(C(C)C)=CC=CC1)=O