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

*Links on SpectraBase are not permalinks.
Naphthalene-2,6-dicarboxylic acid, 4-methoxyphenyl ester 4-pentylphenyl ester
SpectraBase Compound ID CDjz6WvQsXv
InChI InChI=1S/C30H28O5/c1-3-4-5-6-21-7-13-27(14-8-21)34-29(31)24-11-9-23-20-25(12-10-22(23)19-24)30(32)35-28-17-15-26(33-2)16-18-28/h7-20H,3-6H2,1-2H3
InChIKey IQHUJSLRUFZAKS-UHFFFAOYSA-N
Mol Weight 468.55 g/mol
Molecular Formula C30H28O5
Exact Mass 468.193674 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 7Z7X2Qn1wws
Name Naphthalene-2,6-dicarboxylic acid, 4-methoxyphenyl ester 4-pentylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.193673997 u
Formula C30H28O5
InChI InChI=1S/C30H28O5/c1-3-4-5-6-21-7-13-27(14-8-21)34-29(31)24-11-9-23-20-25(12-10-22(23)19-24)30(32)35-28-17-15-26(33-2)16-18-28/h7-20H,3-6H2,1-2H3
InChIKey IQHUJSLRUFZAKS-UHFFFAOYSA-N
Molecular Weight 468.549 g/mol
SMILES C1=C(CCCCC)C=CC(=C1)OC(C1=CC2=CC=C(C(OC3=CC=C(OC)C=C3)=O)C=C2C=C1)=O