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5-tert-butyl-2-(4,4-dimethyl-1,2-diphenyl-3-oxo-1-pentenyl)benzoic acid

View entire compound with spectra: 1 NMR, and 1 FTIR

5-tert-butyl-2-(4,4-dimethyl-1,2-diphenyl-3-oxo-1-pentenyl)benzoic acid
SpectraBase Compound ID 312bX3kXOHf
InChI InChI=1S/C30H32O3/c1-29(2,3)22-17-18-23(24(19-22)28(32)33)25(20-13-9-7-10-14-20)26(27(31)30(4,5)6)21-15-11-8-12-16-21/h7-19H,1-6H3,(H,32,33)
InChIKey YUBDCKXOHXQLJM-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C30H32O3
Exact Mass 440.235145 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IRLI1zDLBoI
Name 5-tert-BUTYL-2-(4,4-DIMETHYL-1,2-DIPHENYL-3-OXO-1-PENTENYL)BENZOIC ACID
Source of Sample H. M. Crawford, Vassar College, Poughkeepsie, New York
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H32O3
InChI InChI=1S/C30H32O3/c1-29(2,3)22-17-18-23(24(19-22)28(32)33)25(20-13-9-7-10-14-20)26(27(31)30(4,5)6)21-15-11-8-12-16-21/h7-19H,1-6H3,(H,32,33)
InChIKey YUBDCKXOHXQLJM-UHFFFAOYSA-N
Literature Reference J. ORG. CHEM. 36, 3533(1971)
Melting Point 176-177C
Molecular Weight 440.583008
Synonyms BENZOIC ACID, 5-TERT-BUTYL- 2-/4,4-DIMETHYL-1,2-DIPHENYL-3-OXO- 1-PENTENYL/-,
Technique KBr WAFER