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Phthalic acid, 3-methylphenyl 3-phenylpropyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 3-methylphenyl 3-phenylpropyl ester
SpectraBase Compound ID 40IhPda6EHw
InChI InChI=1S/C24H22O4/c1-18-9-7-13-20(17-18)28-24(26)22-15-6-5-14-21(22)23(25)27-16-8-12-19-10-3-2-4-11-19/h2-7,9-11,13-15,17H,8,12,16H2,1H3
InChIKey ZHTKKAWWZPWYSP-UHFFFAOYSA-N
Mol Weight 374.44 g/mol
Molecular Formula C24H22O4
Exact Mass 374.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 99IPbJVkz4a
Name Phthalic acid, 3-methylphenyl 3-phenylpropyl ester
Comments Computed using HOSE algorithm
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Exact Mass 374.151809184 u
Formula C24H22O4
InChI InChI=1S/C24H22O4/c1-18-9-7-13-20(17-18)28-24(26)22-15-6-5-14-21(22)23(25)27-16-8-12-19-10-3-2-4-11-19/h2-7,9-11,13-15,17H,8,12,16H2,1H3
InChIKey ZHTKKAWWZPWYSP-UHFFFAOYSA-N
Molecular Weight 374.436 g/mol
SMILES C(OCCCC1=CC=CC=C1)(=O)C1=C(C=CC=C1)C(OC1=CC(C)=CC=C1)=O