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3-(2,4-Dimethyl-benzoyl)-3-(2-imidazolidinylidene)-propionic acid, ethyl ester

View entire compound with spectra: 1 NMR

3-(2,4-Dimethyl-benzoyl)-3-(2-imidazolidinylidene)-propionic acid, ethyl ester
SpectraBase Compound ID 7OUVFuixiVB
InChI InChI=1S/C17H22N2O3/c1-4-22-15(20)10-14(17-18-7-8-19-17)16(21)13-6-5-11(2)9-12(13)3/h5-6,9,18-19H,4,7-8,10H2,1-3H3
InChIKey OAPSYFKLBQEEBX-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C17H22N2O3
Exact Mass 302.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Enp1Q0bILiF
Name 3-(2,4-Dimethyl-benzoyl)-3-(2-imidazolidinylidene)-propionic acid, ethyl ester
CAS Registry Number 115859-74-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H22N2O3
InChI InChI=1S/C17H22N2O3/c1-4-22-15(20)10-14(17-18-7-8-19-17)16(21)13-6-5-11(2)9-12(13)3/h5-6,9,18-19H,4,7-8,10H2,1-3H3
InChIKey OAPSYFKLBQEEBX-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference Z. Huang, Z. Liu, Chem. Ber. 112, 95 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3