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3-Dimethylaminomethyl-4-(N-anilino)-3-buten-2-one
SpectraBase Compound ID 5NHwoCfsSKC
InChI InChI=1S/C13H18N2O/c1-11(16)12(10-15(2)3)9-14-13-7-5-4-6-8-13/h4-9,14H,10H2,1-3H3/b12-9-
InChIKey WLMIOLPAOYWURK-XFXZXTDPSA-N
Mol Weight 218.3 g/mol
Molecular Formula C13H18N2O
Exact Mass 218.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A56EddAtLLw
Name 3-Dimethylaminomethyl-4-(N-anilino)-3-buten-2-one
CAS Registry Number 98662-16-9
Comments Z-ISOMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H18N2O
InChI InChI=1S/C13H18N2O/c1-11(16)12(10-15(2)3)9-14-13-7-5-4-6-8-13/h4-9,14H,10H2,1-3H3/b12-9-
InChIKey WLMIOLPAOYWURK-XFXZXTDPSA-N
Instrument Name Varian CFT-20
Literature Reference H. Moehrle, H.W. Reinhardt, Arch. Pharm. 314, 767 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3