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

*Links on SpectraBase are not permalinks.

Phthalic acid, 2-ethylcyclohexyl undecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-ethylcyclohexyl undecyl ester
SpectraBase Compound ID EnBr9CqMYXB
InChI InChI=1S/C27H42O4/c1-3-5-6-7-8-9-10-11-16-21-30-26(28)23-18-13-14-19-24(23)27(29)31-25-20-15-12-17-22(25)4-2/h13-14,18-19,22,25H,3-12,15-17,20-21H2,1-2H3
InChIKey RTNRDCDMUIIBKB-UHFFFAOYSA-N
Mol Weight 430.6 g/mol
Molecular Formula C27H42O4
Exact Mass 430.30831 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 BYUckK77OEc
Name Phthalic acid, 2-ethylcyclohexyl undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.308309828 u
Formula C27H42O4
InChI InChI=1S/C27H42O4/c1-3-5-6-7-8-9-10-11-16-21-30-26(28)23-18-13-14-19-24(23)27(29)31-25-20-15-12-17-22(25)4-2/h13-14,18-19,22,25H,3-12,15-17,20-21H2,1-2H3
InChIKey RTNRDCDMUIIBKB-UHFFFAOYSA-N
Molecular Weight 430.629 g/mol
SMILES CCCCCCCCCCCOC(C1=C(C(OC2C(CCCC2)CC)=O)C=CC=C1)=O