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Phthalic acid, 4-methoxyphenyl 2-methylphenyl ester
SpectraBase Compound ID IZyUjQbBW3t
InChI InChI=1S/C22H18O5/c1-15-7-3-6-10-20(15)27-22(24)19-9-5-4-8-18(19)21(23)26-17-13-11-16(25-2)12-14-17/h3-14H,1-2H3
InChIKey MYKYTBCNBHYPCJ-UHFFFAOYSA-N
Mol Weight 362.38 g/mol
Molecular Formula C22H18O5
Exact Mass 362.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3y5fHPCcKq
Name Phthalic acid, 4-methoxyphenyl 2-methylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 362.115423675 u
Formula C22H18O5
InChI InChI=1S/C22H18O5/c1-15-7-3-6-10-20(15)27-22(24)19-9-5-4-8-18(19)21(23)26-17-13-11-16(25-2)12-14-17/h3-14H,1-2H3
InChIKey MYKYTBCNBHYPCJ-UHFFFAOYSA-N
Molecular Weight 362.381 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC=C(OC)C=C1)=O)C(OC1=CC=CC=C1C)=O