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

*Links on SpectraBase are not permalinks.

Adipic acid, phenyl tetradecyl ester

View entire compound with spectra: 1 NMR

Adipic acid, phenyl tetradecyl ester
SpectraBase Compound ID GmqEtvSMXKK
InChI InChI=1S/C26H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-18-23-29-25(27)21-16-17-22-26(28)30-24-19-14-13-15-20-24/h13-15,19-20H,2-12,16-18,21-23H2,1H3
InChIKey JMJPJHOMCPCCRA-UHFFFAOYSA-N
Mol Weight 418.6 g/mol
Molecular Formula C26H42O4
Exact Mass 418.30831 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 Fry9b7PvgoQ
Name Adipic acid, phenyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.308309828 u
Formula C26H42O4
InChI InChI=1S/C26H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-18-23-29-25(27)21-16-17-22-26(28)30-24-19-14-13-15-20-24/h13-15,19-20H,2-12,16-18,21-23H2,1H3
InChIKey JMJPJHOMCPCCRA-UHFFFAOYSA-N
Molecular Weight 418.618 g/mol
SMILES C(=O)(CCCCC(OCCCCCCCCCCCCCC)=O)OC1=CC=CC=C1