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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AxMysgdNhD
Name 1-(1,1,3-TRIMETHYL-2-CYCLOHEXEN-2-YL)-3-METHYL-6-(4-CARBOXYPHENYL)HEXATRIENE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Molecular Weight 336.2082
SMILES OC(=O)c1ccc(cc1)\C=C\C=C/(C)\C=C\C=1C(C)(C)CCCC1C
SPLASH splash10-00ko-9522000000-a0812582c552e557bef9
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany