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

*Links on SpectraBase are not permalinks.
Naphthalene-2,6-dicarboxylic acid pentyl ester 4-pentyl-phenyl ester
SpectraBase Compound ID Bz5NK7xIUtt
InChI InChI=1S/C28H32O4/c1-3-5-7-9-21-10-16-26(17-11-21)32-28(30)25-15-13-22-19-24(14-12-23(22)20-25)27(29)31-18-8-6-4-2/h10-17,19-20H,3-9,18H2,1-2H3
InChIKey KWABGZZXUBHVSZ-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C28H32O4
Exact Mass 432.23006 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 IWwCAyjqvda
Name Naphthalene-2,6-dicarboxylic acid, pentyl ester 4-pentyl-phenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 432.230059506 u
Formula C28H32O4
InChI InChI=1S/C28H32O4/c1-3-5-7-9-21-10-16-26(17-11-21)32-28(30)25-15-13-22-19-24(14-12-23(22)20-25)27(29)31-18-8-6-4-2/h10-17,19-20H,3-9,18H2,1-2H3
InChIKey KWABGZZXUBHVSZ-UHFFFAOYSA-N
Molecular Weight 432.560 g/mol
SMILES C(CC1=CC=C(C=C1)OC(C1=CC2=CC=C(C(=O)OCCCCC)C=C2C=C1)=O)CCC