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2-[3-methyl-5-(4-nitrophenyl)-4-propylpyrazol-1-yl]-1,2-di(phenyl)ethanone
SpectraBase Compound ID 6FxlK1ZsJe
InChI InChI=1S/C27H25N3O3/c1-3-10-24-19(2)28-29(25(24)21-15-17-23(18-16-21)30(32)33)26(20-11-6-4-7-12-20)27(31)22-13-8-5-9-14-22/h4-9,11-18,26H,3,10H2,1-2H3
InChIKey VXRWVUHEMJDDRK-UHFFFAOYSA-N
Mol Weight 439.52 g/mol
Molecular Formula C27H25N3O3
Exact Mass 439.189592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HYuwDOoMRIw
Name 2-[3-methyl-5-(4-nitrophenyl)-4-propylpyrazol-1-yl]-1,2-di(phenyl)ethanone
Compound Number 758
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H25N3O3
InChI InChI=1S/C27H25N3O3/c1-3-10-24-19(2)28-29(25(24)21-15-17-23(18-16-21)30(32)33)26(20-11-6-4-7-12-20)27(31)22-13-8-5-9-14-22/h4-9,11-18,26H,3,10H2,1-2H3
InChIKey VXRWVUHEMJDDRK-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 439.514 g/mol
Solvent CDCl3
Source File Reference UWVP1425