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Ethyl 5-[(2-chlorobenzyl)oxy]-2-phenyl-1-benzofuran-3-carboxylate
SpectraBase Compound ID 87ZQ7LOLwOS
InChI InChI=1S/C24H19ClO4/c1-2-27-24(26)22-19-14-18(28-15-17-10-6-7-11-20(17)25)12-13-21(19)29-23(22)16-8-4-3-5-9-16/h3-14H,2,15H2,1H3
InChIKey PUJQBOOUCKXYIC-UHFFFAOYSA-N
Mol Weight 406.87 g/mol
Molecular Formula C24H19ClO4
Exact Mass 406.097187 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 52oUdeF31ZP
Name Ethyl 5-[(2-chlorobenzyl)oxy]-2-phenyl-1-benzofuran-3-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 406.097186788 u
Formula C24H19ClO4
InChI InChI=1S/C24H19ClO4/c1-2-27-24(26)22-19-14-18(28-15-17-10-6-7-11-20(17)25)12-13-21(19)29-23(22)16-8-4-3-5-9-16/h3-14H,2,15H2,1H3
InChIKey PUJQBOOUCKXYIC-UHFFFAOYSA-N
Molecular Weight 406.865 g/mol
SMILES C1(=C(OC=2C1=CC(OCC1=C(Cl)C=CC=C1)=CC2)C=1C=CC=CC1)C(=O)OCC