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

*Links on SpectraBase are not permalinks.

Phthalic acid, mono(2-ethyl-hexyl) ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Phthalic acid, mono(2-ethyl-hexyl) ester
SpectraBase Compound ID 863sbKtg104
InChI InChI=1S/C16H22O4/c1-3-5-8-12(4-2)11-20-16(19)14-10-7-6-9-13(14)15(17)18/h6-7,9-10,12H,3-5,8,11H2,1-2H3,(H,17,18)
InChIKey DJDSLBVSSOQSLW-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 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 Axz3TX1gui8
Name Phthalic acid, mono(2-ethyl-hexyl) ester
CAS Registry Number 4376-20-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-3-5-8-12(4-2)11-20-16(19)14-10-7-6-9-13(14)15(17)18/h6-7,9-10,12H,3-5,8,11H2,1-2H3,(H,17,18)
InChIKey DJDSLBVSSOQSLW-UHFFFAOYSA-N
Instrument Name Jeol PS-100
Literature Reference C.S. Giam, T.E. Goodwin, T.K.Yano, J. Chem. Soc. Perkin II 831 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3