For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Sebacic acid, di(3-ethylphenyl) ester

View entire compound with spectra: 1 NMR

Sebacic acid, di(3-ethylphenyl) ester
SpectraBase Compound ID BDg36K1bQhL
InChI InChI=1S/C26H34O4/c1-3-21-13-11-15-23(19-21)29-25(27)17-9-7-5-6-8-10-18-26(28)30-24-16-12-14-22(4-2)20-24/h11-16,19-20H,3-10,17-18H2,1-2H3
InChIKey IPGFBWALSOCWRT-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C26H34O4
Exact Mass 410.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EYp7nCPPTzb
Name Sebacic acid, di(3-ethylphenyl) ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.245709571 u
Formula C26H34O4
InChI InChI=1S/C26H34O4/c1-3-21-13-11-15-23(19-21)29-25(27)17-9-7-5-6-8-10-18-26(28)30-24-16-12-14-22(4-2)20-24/h11-16,19-20H,3-10,17-18H2,1-2H3
InChIKey IPGFBWALSOCWRT-UHFFFAOYSA-N
Molecular Weight 410.554 g/mol
SMILES C(CCCCCC(OC1=CC(CC)=CC=C1)=O)CCC(OC1=CC=CC(CC)=C1)=O