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4-(4-N,N-Diethylamino-2-tolylimino)-3-methyl-1-(2-nitro-phenyl)-2-pyrazolin-5-one
SpectraBase Compound ID GiQisDOWSmS
InChI InChI=1S/C21H23N5O3/c1-5-24(6-2)16-11-12-17(14(3)13-16)22-20-15(4)23-25(21(20)27)18-9-7-8-10-19(18)26(28)29/h7-13H,5-6H2,1-4H3/b22-20-
InChIKey OBENJIGXNKCDOP-XDOYNYLZSA-N
Mol Weight 393.45 g/mol
Molecular Formula C21H23N5O3
Exact Mass 393.18009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LBS51hOfmSs
Name 4-(4-N,N-Diethylamino-2-tolylimino)-3-methyl-1-(2-nitro-phenyl)-2-pyrazolin-5-one
Comments BRUKER MSL-300 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H23N5O3
InChI InChI=1S/C21H23N5O3/c1-5-24(6-2)16-11-12-17(14(3)13-16)22-20-15(4)23-25(21(20)27)18-9-7-8-10-19(18)26(28)29/h7-13H,5-6H2,1-4H3/b22-20-
InChIKey OBENJIGXNKCDOP-XDOYNYLZSA-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