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HEXAKIS-[4-[(HYDROXYIMINO)-METHYL]-PHENOXY]-CYCLOTRIPHOSPHAZENE;MINOR-ISOMER
SpectraBase Compound ID 3Aw9gfA11ty
InChI InChI=1S/C42H36N9O12P3/c52-43-25-31-1-13-37(14-2-31)58-64(59-38-15-3-32(4-16-38)26-44-53)49-65(60-39-17-5-33(6-18-39)27-45-54,61-40-19-7-34(8-20-40)28-46-55)51-66(50-64,62-41-21-9-35(10-22-41)29-47-56)63-42-23-11-36(12-24-42)30-48-57/h1-30,52-57H/b43-25-,44-26-,45-27-,46-28-,47-29-,48-30-
InChIKey AHTPERSDAZFYIN-LKXYKDKTSA-N
Mol Weight 951.7 g/mol
Molecular Formula C42H36N9O12P3
Exact Mass 951.169629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 480hGsIGKCI
Name HEXAKIS-[4-[(HYDROXYIMINO)-METHYL]-PHENOXY]-CYCLOTRIPHOSPHAZENE;MINOR-ISOMER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H30N9O12P3
InChI InChI=1S/C42H36N9O12P3/c52-43-25-31-1-13-37(14-2-31)58-64(59-38-15-3-32(4-16-38)26-44-53)49-65(60-39-17-5-33(6-18-39)27-45-54,61-40-19-7-34(8-20-40)28-46-55)51-66(50-64,62-41-21-9-35(10-22-41)29-47-56)63-42-23-11-36(12-24-42)30-48-57/h1-30,52-57H/b43-25-,44-26-,45-27-,46-28-,47-29-,48-30-
InChIKey AHTPERSDAZFYIN-LKXYKDKTSA-N
Literature Reference Author E.CIL,M.ARSLAN,A.O.GOERGUELUE
Literature Reference Citation CAN.J.CHEM.,83,2039(2005)
Literature Reference DOI 10.1139/v05-223
Molecular Weight 945.675 g/mol
Solvent ACETONE-D6
Source File Reference UWLU30344