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HEXAKIS-[4-[(ETHOXYIMINO)-METHYL]-PHENOXY]-CYCLOTRIPHOSPHAZENE
SpectraBase Compound ID 7jxzMPhv6pE
InChI InChI=1S/C54H60N9O12P3/c1-7-64-55-37-43-13-25-49(26-14-43)70-76(71-50-27-15-44(16-28-50)38-56-65-8-2)61-77(72-51-29-17-45(18-30-51)39-57-66-9-3,73-52-31-19-46(20-32-52)40-58-67-10-4)63-78(62-76,74-53-33-21-47(22-34-53)41-59-68-11-5)75-54-35-23-48(24-36-54)42-60-69-12-6/h13-42H,7-12H2,1-6H3/b55-37+,56-38+,57-39+,58-40+,59-41+,60-42+
InChIKey XUQKOHBQBCJXKT-PPHPZBIGSA-N
Mol Weight 1120.0 g/mol
Molecular Formula C54H60N9O12P3
Exact Mass 1119.357429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ec4R5U4iCUS
Name HEXAKIS-[4-[(ETHOXYIMINO)-METHYL]-PHENOXY]-CYCLOTRIPHOSPHAZENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H60N9O12P3
InChI InChI=1S/C54H60N9O12P3/c1-7-64-55-37-43-13-25-49(26-14-43)70-76(71-50-27-15-44(16-28-50)38-56-65-8-2)61-77(72-51-29-17-45(18-30-51)39-57-66-9-3,73-52-31-19-46(20-32-52)40-58-67-10-4)63-78(62-76,74-53-33-21-47(22-34-53)41-59-68-11-5)75-54-35-23-48(24-36-54)42-60-69-12-6/h13-42H,7-12H2,1-6H3/b55-37+,56-38+,57-39+,58-40+,59-41+,60-42+
InChIKey XUQKOHBQBCJXKT-PPHPZBIGSA-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 1120.045 g/mol
Solvent ACETONE-D6
Source File Reference UWLU30345