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Glutaric acid, 3-chlorophenyl 3-phenoxybenzyl ester
SpectraBase Compound ID Ev8UnlmBAx5
InChI InChI=1S/C24H21ClO5/c25-19-8-5-12-22(16-19)30-24(27)14-6-13-23(26)28-17-18-7-4-11-21(15-18)29-20-9-2-1-3-10-20/h1-5,7-12,15-16H,6,13-14,17H2
InChIKey GEYKCJMNEIURQX-UHFFFAOYSA-N
Mol Weight 424.88 g/mol
Molecular Formula C24H21ClO5
Exact Mass 424.107751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2RXiiuDPExG
Name Glutaric acid, 3-chlorophenyl 3-phenoxybenzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.107751471 u
Formula C24H21ClO5
InChI InChI=1S/C24H21ClO5/c25-19-8-5-12-22(16-19)30-24(27)14-6-13-23(26)28-17-18-7-4-11-21(15-18)29-20-9-2-1-3-10-20/h1-5,7-12,15-16H,6,13-14,17H2
InChIKey GEYKCJMNEIURQX-UHFFFAOYSA-N
Molecular Weight 424.880 g/mol
SMILES C(CCC(OC1=CC(=CC=C1)Cl)=O)C(OCC1=CC=CC(OC2=CC=CC=C2)=C1)=O