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1-(2,6-Dichloro-phenyl)-4-(4-N,N-diethylamino-2-tolylimino)-3-methyl-2-pyrazolin-5-one
SpectraBase Compound ID DuEIsobDi9i
InChI InChI=1S/C21H22Cl2N4O/c1-5-26(6-2)15-10-11-18(13(3)12-15)24-19-14(4)25-27(21(19)28)20-16(22)8-7-9-17(20)23/h7-12H,5-6H2,1-4H3/b24-19-
InChIKey IHMKVCHAMMVEGJ-CLCOLTQESA-N
Mol Weight 417.34 g/mol
Molecular Formula C21H22Cl2N4O
Exact Mass 416.117067 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10nffXGo1PR
Name 1-(2,6-Dichloro-phenyl)-4-(4-N,N-diethylamino-2-tolylimino)-3-methyl-2-pyrazolin-5-one
Comments BRUKER MSL-300 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H22Cl2N4O
InChI InChI=1S/C21H22Cl2N4O/c1-5-26(6-2)15-10-11-18(13(3)12-15)24-19-14(4)25-27(21(19)28)20-16(22)8-7-9-17(20)23/h7-12H,5-6H2,1-4H3/b24-19-
InChIKey IHMKVCHAMMVEGJ-CLCOLTQESA-N
Instrument Name see comment
Literature Reference R. Haessner, L. Hennig, J. Gaca, Magn. Res. Chem. 28, 817 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3