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2,6-BIS-[4-ADAMANTANE-1-YL)-PHENYL]-4-[4-(TERT.-BUTYL)-PHENYL]-1-[4-HYDROXY-3,5-BIS-[4-(TERT.-BUTYL)-PHENYL]-PHENYL]-PYRIDINIUM-PERCHLORATE

View entire compound with spectra: 1 NMR

2,6-BIS-[4-ADAMANTANE-1-YL)-PHENYL]-4-[4-(TERT.-BUTYL)-PHENYL]-1-[4-HYDROXY-3,5-BIS-[4-(TERT.-BUTYL)-PHENYL]-PHENYL]-PYRIDINIUM-PERCHLORATE
SpectraBase Compound ID 443l0ZXRrx9
InChI InChI=1S/C73H81NO.ClHO4/c1-69(2,3)58-20-10-52(11-21-58)57-36-66(55-16-26-61(27-17-55)72-40-46-30-47(41-72)32-48(31-46)42-72)74(67(37-57)56-18-28-62(29-19-56)73-43-49-33-50(44-73)35-51(34-49)45-73)63-38-64(53-12-22-59(23-13-53)70(4,5)6)68(75)65(39-63)54-14-24-60(25-15-54)71(7,8)9;2-1(3,4)5/h10-29,36-39,46-51H,30-35,40-45H2,1-9H3;(H,2,3,4,5)/t46-,47+,48-,49-,50+,51-,72-,73-;
InChIKey SODDQUOZIKGRJB-APJQSKATSA-N
Mol Weight 1088.91 g/mol
Molecular Formula C73H82ClNO5
Exact Mass 1087.588152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7RTjuzBozX
Name 2,6-BIS-[4-ADAMANTANE-1-YL)-PHENYL]-4-[4-(TERT.-BUTYL)-PHENYL]-1-[4-HYDROXY-3,5-BIS-[4-(TERT.-BUTYL)-PHENYL]-PHENYL]-PYRIDINIUM-PERCHLORATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C73H82ClNO5
InChI InChI=1S/C73H81NO.ClHO4/c1-69(2,3)58-20-10-52(11-21-58)57-36-66(55-16-26-61(27-17-55)72-40-46-30-47(41-72)32-48(31-46)42-72)74(67(37-57)56-18-28-62(29-19-56)73-43-49-33-50(44-73)35-51(34-49)45-73)63-38-64(53-12-22-59(23-13-53)70(4,5)6)68(75)65(39-63)54-14-24-60(25-15-54)71(7,8)9;2-1(3,4)5/h10-29,36-39,46-51H,30-35,40-45H2,1-9H3;(H,2,3,4,5)/t46-,47+,48-,49-,50+,51-,72-,73-;
InChIKey SODDQUOZIKGRJB-APJQSKATSA-N
Literature Reference Author C.REICHARDT,S.LOEBBECKE,A.M.MEHRANPOUR,G.SCHAEFER
Literature Reference Citation CAN.J.CHEM.,76,686(1998)
Literature Reference DOI 10.1139/cjc-76-6-686
Molecular Weight 1088.911 g/mol
Solvent CDCl3
Source File Reference UWCP1825