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2-[1-(3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-4-YL)-1-PHENYL-ETHYL]-MALONONITRILE
SpectraBase Compound ID FtNokUKOPs9
InChI InChI=1S/C15H14N4O/c1-9-12-14(19-18-9)20-13(17)11(8-16)15(12,2)10-6-4-3-5-7-10/h3-7H,17H2,1-2H3,(H,18,19)
InChIKey CFWZTWHINFKEJJ-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C15H14N4O
Exact Mass 266.116761 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IX3nCGdPGqO
Name 2-[1-(3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-4-YL)-1-PHENYL-ETHYL]-MALONONITRILE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H14N4O
InChI InChI=1S/C15H14N4O/c1-9-12-14(19-18-9)20-13(17)11(8-16)15(12,2)10-6-4-3-5-7-10/h3-7H,17H2,1-2H3,(H,18,19)
InChIKey CFWZTWHINFKEJJ-UHFFFAOYSA-N
Literature Reference Author H.M.AL-MATAR,K.D.KHALIL,A.Y.ADAM,M.H.ELNAGDI
Literature Reference Citation MOLECULES,15,6619(2010)
Literature Reference DOI 10.3390/molecules15096619
Molecular Weight 266.302 g/mol
Sample ID 72455
Solvent DMSO-D6