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Glutaric acid, octyl 3-phenoxybenzyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, octyl 3-phenoxybenzyl ester
SpectraBase Compound ID 1ehRaucPsXU
InChI InChI=1S/C26H34O5/c1-2-3-4-5-6-10-19-29-25(27)17-12-18-26(28)30-21-22-13-11-16-24(20-22)31-23-14-8-7-9-15-23/h7-9,11,13-16,20H,2-6,10,12,17-19,21H2,1H3
InChIKey ZHKNZQZGMRJBMH-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C26H34O5
Exact Mass 426.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CG0yj8zws5f
Name Glutaric acid, octyl 3-phenoxybenzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.240624190 u
Formula C26H34O5
InChI InChI=1S/C26H34O5/c1-2-3-4-5-6-10-19-29-25(27)17-12-18-26(28)30-21-22-13-11-16-24(20-22)31-23-14-8-7-9-15-23/h7-9,11,13-16,20H,2-6,10,12,17-19,21H2,1H3
InChIKey ZHKNZQZGMRJBMH-UHFFFAOYSA-N
Molecular Weight 426.553 g/mol
SMILES CCCCCCCCOC(CCCC(OCC1=CC(=CC=C1)OC1=CC=CC=C1)=O)=O