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Phthalic acid, benzyl 3-phenylpropyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, benzyl 3-phenylpropyl ester
SpectraBase Compound ID 4V8SYIRDJhM
InChI InChI=1S/C24H22O4/c25-23(27-17-9-14-19-10-3-1-4-11-19)21-15-7-8-16-22(21)24(26)28-18-20-12-5-2-6-13-20/h1-8,10-13,15-16H,9,14,17-18H2
InChIKey ZFOXILRLZQEDNY-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 3hIZ7WXD9XE
Name Phthalic acid, benzyl 3-phenylpropyl ester
Comments Computed using HOSE algorithm
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Exact Mass 374.151809184 u
Formula C24H22O4
InChI InChI=1S/C24H22O4/c25-23(27-17-9-14-19-10-3-1-4-11-19)21-15-7-8-16-22(21)24(26)28-18-20-12-5-2-6-13-20/h1-8,10-13,15-16H,9,14,17-18H2
InChIKey ZFOXILRLZQEDNY-UHFFFAOYSA-N
Molecular Weight 374.436 g/mol
SMILES C1=C(C(=CC=C1)C(=O)OCCCC1=CC=CC=C1)C(=O)OCC1=CC=CC=C1