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3-CYANO-2,2,2-TRIPHENYL-2-H-CYCLOHEPTA-[D]-[1.2-LAMBDA-(5)]-OXAPHOSPHOLE
SpectraBase Compound ID 9pgIGYqGrQJ
InChI InChI=1S/C27H20NOP/c28-21-27-25-19-11-4-12-20-26(25)29-30(27,22-13-5-1-6-14-22,23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-20H
InChIKey GUOHAUOPVHXJRQ-UHFFFAOYSA-N
Mol Weight 406.44 g/mol
Molecular Formula C27H21NOP
Exact Mass 406.136076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9mjZoinGfUp
Name 3-CYANO-2,2,2-TRIPHENYL-2-H-CYCLOHEPTA-[D]-[1.2-LAMBDA-(5)]-OXAPHOSPHOLE
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H20NOP
InChI InChI=1S/C27H20NOP/c28-21-27-25-19-11-4-12-20-26(25)29-30(27,22-13-5-1-6-14-22,23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-20H
InChIKey GUOHAUOPVHXJRQ-UHFFFAOYSA-N
Literature Reference Author S.I.NAYA,M.NITTA
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1017(2002)
Literature Reference DOI 10.1039/b109076n
Molecular Weight 405.436 g/mol
Solvent CDCl3
Source File Reference UWMZ22086