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

*Links on SpectraBase are not permalinks.

Phthalic acid, monoamide, N-ethyl-N-phenyl-, hexyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, monoamide, N-ethyl-N-phenyl-, hexyl ester
SpectraBase Compound ID D7eUlonddLo
InChI InChI=1S/C22H27NO3/c1-3-5-6-12-17-26-22(25)20-16-11-10-15-19(20)21(24)23(4-2)18-13-8-7-9-14-18/h7-11,13-16H,3-6,12,17H2,1-2H3
InChIKey YPSAQQZTECLCQT-UHFFFAOYSA-N
Mol Weight 353.46 g/mol
Molecular Formula C22H27NO3
Exact Mass 353.199094 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 7QsTlvIuIv1
Name Phthalic acid, monoamide, N-ethyl-N-phenyl-, hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.199093730 u
Formula C22H27NO3
InChI InChI=1S/C22H27NO3/c1-3-5-6-12-17-26-22(25)20-16-11-10-15-19(20)21(24)23(4-2)18-13-8-7-9-14-18/h7-11,13-16H,3-6,12,17H2,1-2H3
InChIKey YPSAQQZTECLCQT-UHFFFAOYSA-N
Molecular Weight 353.462 g/mol
SMILES C1(=C(C=CC=C1)C(=O)N(CC)C1=CC=CC=C1)C(OCCCCCC)=O