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

*Links on SpectraBase are not permalinks.
Phthalic acid, phenyl propyl ester
SpectraBase Compound ID AXkNgHgYS5a
InChI InChI=1S/C17H16O4/c1-2-12-20-16(18)14-10-6-7-11-15(14)17(19)21-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3
InChIKey UXRKFDNQBWIPFE-UHFFFAOYSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 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 ElKig8qhxXV
Name Phthalic acid, phenyl propyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.104858991 u
Formula C17H16O4
InChI InChI=1S/C17H16O4/c1-2-12-20-16(18)14-10-6-7-11-15(14)17(19)21-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3
InChIKey UXRKFDNQBWIPFE-UHFFFAOYSA-N
SMILES C1(=C(C=CC=C1)C(OC1=CC=CC=C1)=O)C(=O)OCCC