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1-(3,5-diphenyl-4-hydroxyphenyl)-2,4,6-tri-p-tolylpyridinium hydroxide, inner salt, dihydrate

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1-(3,5-diphenyl-4-hydroxyphenyl)-2,4,6-tri-p-tolylpyridinium hydroxide, inner salt, dihydrate
SpectraBase Compound ID 3jgdJY6zn11
InChI InChI=1S/C44H35NO.2H2O/c1-30-14-20-33(21-15-30)38-26-42(36-22-16-31(2)17-23-36)45(43(27-38)37-24-18-32(3)19-25-37)39-28-40(34-10-6-4-7-11-34)44(46)41(29-39)35-12-8-5-9-13-35;;/h4-29H,1-3H3;2*1H2
InChIKey XSTBNUKTOPIHTP-UHFFFAOYSA-N
Mol Weight 629.8 g/mol
Molecular Formula C44H39NO3
Exact Mass 629.292994 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID K43JZ5Xmwg3
Name 1-(3,5-DIPHENYL-4-HYDROXYPHENYL)-2,4,6-TRI-p-TOLYLPYRIDINIUM HYDROXIDE, INNER SALT, DIHYDRATE
Source of Sample C. REICHARDT, PHILLIPPS-UNIVERSITY, MARBURG, GERMANY
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H39NO3
InChI InChI=1S/C44H35NO.2H2O/c1-30-14-20-33(21-15-30)38-26-42(36-22-16-31(2)17-23-36)45(43(27-38)37-24-18-32(3)19-25-37)39-28-40(34-10-6-4-7-11-34)44(46)41(29-39)35-12-8-5-9-13-35;;/h4-29H,1-3H3;2*1H2
InChIKey XSTBNUKTOPIHTP-UHFFFAOYSA-N
Literature Reference LIEBIGS ANN. CHEM. 727, 93(1969) Abstract-Chemical Abstracts= 72, 33227(1970)
Melting Point 236-238C
Molecular Weight 629.799988
Synonyms PHENOXIDE, 3,5-DIPHENYL-4-/2,4,6- TRI-P-TOLYL-1-PYRIDINIO/-, DIHYDRATE PYRIDINIUM HYDROXIDE, 1-/3,5-DI- PHENYL-4-HYDROXYPHENYL/-2,4,6-TRI- P-TOLYL-, INNER SALT, DIHYDRATE
Technique KBr WAFER