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1,3-DIPHENYL-5-CHLORO-4-CYANOACETYLPYRAZOLE
SpectraBase Compound ID LUUPdANbI6x
InChI InChI=1S/C18H12ClN3O/c19-18-16(15(23)11-12-20)17(13-7-3-1-4-8-13)21-22(18)14-9-5-2-6-10-14/h1-10H,11H2
InChIKey KVWIJQRPGIVKTL-UHFFFAOYSA-N
Mol Weight 321.77 g/mol
Molecular Formula C18H12ClN3O
Exact Mass 321.06689 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2i5X29g2fOq
Name 1,3-DIPHENYL-5-CHLORO-4-CYANOACETYLPYRAZOLE
Comments ##
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Formula C18H12ClN3O
InChI InChI=1S/C18H12ClN3O/c19-18-16(15(23)11-12-20)17(13-7-3-1-4-8-13)21-22(18)14-9-5-2-6-10-14/h1-10H,11H2
InChIKey KVWIJQRPGIVKTL-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference A.EL-SHEIKEIL, A.BABQI, M.HASSAN, S.SHIBA (1989) Acta Chimica Hungarica: v.126,N6, 813-820.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d