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Phenylacetic acid, 3,5-dibenzyloxy-, benzyl ester

View entire compound with spectra: 1 NMR

Phenylacetic acid, 3,5-dibenzyloxy-, benzyl ester
SpectraBase Compound ID AH1BttsWRFw
InChI InChI=1S/C29H26O4/c30-29(33-22-25-14-8-3-9-15-25)18-26-16-27(31-20-23-10-4-1-5-11-23)19-28(17-26)32-21-24-12-6-2-7-13-24/h1-17,19H,18,20-22H2
InChIKey DPQRKMLHCZALCI-UHFFFAOYSA-N
Mol Weight 438.52 g/mol
Molecular Formula C29H26O4
Exact Mass 438.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hzXGo0s9K9
Name Phenylacetic acid, 3,5-dibenzyloxy-, benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 438.183109313 u
Formula C29H26O4
InChI InChI=1S/C29H26O4/c30-29(33-22-25-14-8-3-9-15-25)18-26-16-27(31-20-23-10-4-1-5-11-23)19-28(17-26)32-21-24-12-6-2-7-13-24/h1-17,19H,18,20-22H2
InChIKey DPQRKMLHCZALCI-UHFFFAOYSA-N
Molecular Weight 438.523 g/mol
SMILES C1(=CC(=CC(=C1)OCC1=CC=CC=C1)CC(OCC1=CC=CC=C1)=O)OCC1=CC=CC=C1