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Phthalic acid, 2-ethylhexyl 4-methoxyphenyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-ethylhexyl 4-methoxyphenyl ester
SpectraBase Compound ID ErYFT3OlwhX
InChI InChI=1S/C23H28O5/c1-4-6-9-17(5-2)16-27-22(24)20-10-7-8-11-21(20)23(25)28-19-14-12-18(26-3)13-15-19/h7-8,10-15,17H,4-6,9,16H2,1-3H3
InChIKey XMRPQNCBYTYHAG-UHFFFAOYSA-N
Mol Weight 384.47 g/mol
Molecular Formula C23H28O5
Exact Mass 384.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EzChP3trlNQ
Name Phthalic acid, 2-ethylhexyl 4-methoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 384.193673997 u
Formula C23H28O5
InChI InChI=1S/C23H28O5/c1-4-6-9-17(5-2)16-27-22(24)20-10-7-8-11-21(20)23(25)28-19-14-12-18(26-3)13-15-19/h7-8,10-15,17H,4-6,9,16H2,1-3H3
InChIKey XMRPQNCBYTYHAG-UHFFFAOYSA-N
Molecular Weight 384.472 g/mol
SMILES C1=C(C(=CC=C1)C(OC1=CC=C(OC)C=C1)=O)C(OCC(CCCC)CC)=O