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4-[4-(2-phenylethynyl)phenyl]-1-cyclohexanone
SpectraBase Compound ID CGD3q5uONQf
InChI InChI=1S/C20H18O/c21-20-14-12-19(13-15-20)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-11,19H,12-15H2
InChIKey DCBWANBFCPELHR-UHFFFAOYSA-N
Mol Weight 274.36 g/mol
Molecular Formula C20H18O
Exact Mass 274.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aypPCE4fI
Name 4-[4-(2-phenylethynyl)phenyl]-1-cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O
InChI InChI=1S/C20H18O/c21-20-14-12-19(13-15-20)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-11,19H,12-15H2
InChIKey DCBWANBFCPELHR-UHFFFAOYSA-N
Molecular Weight 274.363 g/mol
SMILES C(#Cc1ccccc1)c1ccc(cc1)C1CCC(CC1)=O
SPLASH splash10-0fk9-1190000000-4d6e7d051284dea4824a
Source of Spectrum J-59-1860-5
Synonyms 4-[4-(2-phenylethynyl)phenyl]cyclohexan-1-one 4-[4-(2-Phenylethynyl)phenyl]cyclohexanone
Wiley ID 1278733