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BIS-(5-AMINO-1-BENZYL-4-PYRAZOLYL)-PHENYLMETHANE
SpectraBase Compound ID BCAQ6cNtbtM
InChI InChI=1S/C29H30N6/c1-20-25(28(30)34(32-20)18-22-12-6-3-7-13-22)27(24-16-10-5-11-17-24)26-21(2)33-35(29(26)31)19-23-14-8-4-9-15-23/h3-17,27H,18-19,30-31H2,1-2H3
InChIKey BKYFMCPFMIOTMX-UHFFFAOYSA-N
Mol Weight 462.6 g/mol
Molecular Formula C29H30N6
Exact Mass 462.253195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ENxnXsMk8wn
Name BIS-(5-AMINO-1-BENZYL-4-PYRAZOLYL)-PHENYLMETHANE
CAS Registry Number 137968-31-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H30N6
InChI InChI=1S/C29H30N6/c1-20-25(28(30)34(32-20)18-22-12-6-3-7-13-22)27(24-16-10-5-11-17-24)26-21(2)33-35(29(26)31)19-23-14-8-4-9-15-23/h3-17,27H,18-19,30-31H2,1-2H3
InChIKey BKYFMCPFMIOTMX-UHFFFAOYSA-N
Literature Reference Author L.SALAZAR,M.ESPADA,C.AVENDANO,R.M.CLARAMUNT,D.SANZ,J.ELGUERO
Literature Reference Citation J.ORG.CHEM.,57,1563(1992)
Literature Reference DOI 10.1021/jo00031a042
Molecular Weight 462.597 g/mol
Solvent CDCl3
Source File Reference UWCS607