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(+-)-1-[(p-Acetylphenyl)methylene]-4-[4'-(phenylethynyl)phenyl]cyclohexane
SpectraBase Compound ID BWAW1Omlvc2
InChI InChI=1S/C29H26O/c1-22(30)27-15-11-25(12-16-27)21-26-13-19-29(20-14-26)28-17-9-24(10-18-28)8-7-23-5-3-2-4-6-23/h2-6,9-12,15-18,21,29H,13-14,19-20H2,1H3/b26-21-
InChIKey XUHUBTHWCJUKSH-QLYXXIJNSA-N
Mol Weight 390.53 g/mol
Molecular Formula C29H26O
Exact Mass 390.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kin4RIkhKgw
Name (+-)-1-[(p-Acetylphenyl)methylene]-4-[4'-(phenylethynyl)phenyl]cyclohexane
Alternate Name(s) 1-[4-({4-[4-(Phenylethynyl)phenyl]cyclohexylidene}methyl)phenyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H26O
InChI InChI=1S/C29H26O/c1-22(30)27-15-11-25(12-16-27)21-26-13-19-29(20-14-26)28-17-9-24(10-18-28)8-7-23-5-3-2-4-6-23/h2-6,9-12,15-18,21,29H,13-14,19-20H2,1H3/b26-21-
InChIKey XUHUBTHWCJUKSH-QLYXXIJNSA-N
Molecular Weight 390.526 g/mol
SMILES C(#Cc1ccccc1)c1ccc(cc1)C1CCC(=Cc2ccc(C(=O)C)cc2)CC1
SPLASH splash10-0006-4469000000-c11c044edc1af3bebe87
Source of Spectrum J-59-1861-16
Wiley ID 1365213