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2-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOLE-4-CARBONYL)-3-(DIMETHYLAMINO)-ACRYLONITRILE
SpectraBase Compound ID FjQCNnKp9xl
InChI InChI=1S/C17H18N4O2/c1-12-15(16(22)13(10-18)11-19(2)3)17(23)21(20(12)4)14-8-6-5-7-9-14/h5-9,11H,1-4H3/b13-11+
InChIKey ZVEGVHCFBOTRAM-ACCUITESSA-N
Mol Weight 310.36 g/mol
Molecular Formula C17H18N4O2
Exact Mass 310.142976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVsO9BFqkS2
Name 2-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOLE-4-CARBONYL)-3-(DIMETHYLAMINO)-ACRYLONITRILE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N4O2
InChI InChI=1S/C17H18N4O2/c1-12-15(16(22)13(10-18)11-19(2)3)17(23)21(20(12)4)14-8-6-5-7-9-14/h5-9,11H,1-4H3/b13-11+
InChIKey ZVEGVHCFBOTRAM-ACCUITESSA-N
Literature Reference Author H.M.AL-MATAR,K.D.KHALIL,M.F.AL-KANDERI,M.H.ELNAGDI
Literature Reference Citation MOLECULES,17,897(2012)
Literature Reference DOI 10.3390/molecules17010897
Molecular Weight 310.356 g/mol
Sample ID 73055
Solvent DMSO-D6