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Phthalic acid, 3-phenoxybenzyl propyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 3-phenoxybenzyl propyl ester
SpectraBase Compound ID 74wYD67s9l5
InChI InChI=1S/C24H22O5/c1-2-15-27-23(25)21-13-6-7-14-22(21)24(26)28-17-18-9-8-12-20(16-18)29-19-10-4-3-5-11-19/h3-14,16H,2,15,17H2,1H3
InChIKey OHOKXXFKHKPSFR-UHFFFAOYSA-N
Mol Weight 390.44 g/mol
Molecular Formula C24H22O5
Exact Mass 390.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bB2HhKZ5tt
Name Phthalic acid, 3-phenoxybenzyl propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 390.146723803 u
Formula C24H22O5
InChI InChI=1S/C24H22O5/c1-2-15-27-23(25)21-13-6-7-14-22(21)24(26)28-17-18-9-8-12-20(16-18)29-19-10-4-3-5-11-19/h3-14,16H,2,15,17H2,1H3
InChIKey OHOKXXFKHKPSFR-UHFFFAOYSA-N
Molecular Weight 390.435 g/mol
SMILES C1(=CC=CC=C1C(OCC1=CC(OC2=CC=CC=C2)=CC=C1)=O)C(OCCC)=O