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4-(4-Methyl-6-[2,6,6-trimethyl-1-cyclohexenyl]-1E,3E,5E-hexatrienyl)-benzoic acid

View entire compound with spectra: 4 NMR, 3 FTIR, and 2 MS (GC)

4-(4-Methyl-6-[2,6,6-trimethyl-1-cyclohexenyl]-1E,3E,5E-hexatrienyl)-benzoic acid
SpectraBase Compound ID ICkTvFOurbf
InChI InChI=1S/C23H28O2/c1-17(10-15-21-18(2)8-6-16-23(21,3)4)7-5-9-19-11-13-20(14-12-19)22(24)25/h5,7,9-15H,6,8,16H2,1-4H3,(H,24,25)/b9-5+,15-10+,17-7+
InChIKey YRNAHKPMDMVFMV-GMICYETFSA-N
Mol Weight 336.48 g/mol
Molecular Formula C23H28O2
Exact Mass 336.20893 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Bk2gyyaIm21
Name 1-(1,1,3-Trimethyl-2-cyclohexen-2-yl)-3-methyl-6-(4-carboxyphenyl)hexatriene
CAS Registry Number 91587-01-8
Comments CHROMATINDEX3.000
Copyright Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C23H28O2
InChI InChI=1S/C23H28O2/c1-17(10-15-21-18(2)8-6-16-23(21,3)4)7-5-9-19-11-13-20(14-12-19)22(24)25/h5,7,9-15H,6,8,16H2,1-4H3,(H,24,25)/b9-5+,15-10+,17-7+
InChIKey YRNAHKPMDMVFMV-GMICYETFSA-N
Instrument Name Bruker IFS 88 C
Synonyms Benzoic acid, 4-[4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatrienyl]-
Technique Mull