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benzoic acid [(Z)-2-(3-methyl-5-phenyl-pyrazol-1-yl)-1,2-di(phenyl)vinyl] ester
SpectraBase Compound ID EJTmigF6bm9
InChI InChI=1S/C31H24N2O2/c1-23-22-28(24-14-6-2-7-15-24)33(32-23)29(25-16-8-3-9-17-25)30(26-18-10-4-11-19-26)35-31(34)27-20-12-5-13-21-27/h2-22H,1H3/b30-29-
InChIKey XLGHOWMEBWKSES-FLWNBWAVSA-N
Mol Weight 456.55 g/mol
Molecular Formula C31H24N2O2
Exact Mass 456.183778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVk33yZOBCw
Name benzoic acid [(Z)-2-(3-methyl-5-phenyl-pyrazol-1-yl)-1,2-di(phenyl)vinyl] ester
Compound Number 972
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H24N2O2
InChI InChI=1S/C31H24N2O2/c1-23-22-28(24-14-6-2-7-15-24)33(32-23)29(25-16-8-3-9-17-25)30(26-18-10-4-11-19-26)35-31(34)27-20-12-5-13-21-27/h2-22H,1H3/b30-29-
InChIKey XLGHOWMEBWKSES-FLWNBWAVSA-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 456.544 g/mol
Solvent CDCl3
Source File Reference UWVP2279