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2,5-BIS-[4-(PYRIDIN-2-YL)-1H-1,2,3-TRIAZOL-1-YL]-1-PHENYLPHOSPHOLE
SpectraBase Compound ID LLNnvoMX1b5
InChI InChI=1S/C40H31N8P/c1-2-16-32(17-3-1)49-39(28-12-10-14-30(24-28)47-26-37(43-45-47)35-20-6-8-22-41-35)33-18-4-5-19-34(33)40(49)29-13-11-15-31(25-29)48-27-38(44-46-48)36-21-7-9-23-42-36/h1-3,6-17,20-27H,4-5,18-19H2
InChIKey RGABCLCGSOOWTP-UHFFFAOYSA-N
Mol Weight 654.7 g/mol
Molecular Formula C40H31N8P
Exact Mass 654.24093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7xqYkyuSoG5
Name 2,5-BIS-[4-(PYRIDIN-2-YL)-1H-1,2,3-TRIAZOL-1-YL]-1-PHENYLPHOSPHOLE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H31N8P
InChI InChI=1S/C40H31N8P/c1-2-16-32(17-3-1)49-39(28-12-10-14-30(24-28)47-26-37(43-45-47)35-20-6-8-22-41-35)33-18-4-5-19-34(33)40(49)29-13-11-15-31(25-29)48-27-38(44-46-48)36-21-7-9-23-42-36/h1-3,6-17,20-27H,4-5,18-19H2
InChIKey RGABCLCGSOOWTP-UHFFFAOYSA-N
Literature Reference Author W.WEYMIENS,F.HARTL,M.LUTZ,J.C.SLOOTWEG,A.W.EHLERS,J.R.MULDER ,K.LAMMERTSMA
Literature Reference Citation EUR.J.ORG.CHEM.,2012,6711(2012)
Literature Reference DOI 10.1002/ejoc.201201148
Molecular Weight 654.714 g/mol
Solvent CDCl3
Source File Reference UWLU83379