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3-(2-Phenylethynyl)cyclohexanone
SpectraBase Compound ID U9EWui9ktP
InChI InChI=1S/C14H14O/c15-14-8-4-7-13(11-14)10-9-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-8,11H2
InChIKey VEJUDXSPIMVDKT-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C14H14O
Exact Mass 198.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HU2rS5shfac
Name 3-(2-Phenylethynyl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O
InChI InChI=1S/C14H14O/c15-14-8-4-7-13(11-14)10-9-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-8,11H2
InChIKey VEJUDXSPIMVDKT-UHFFFAOYSA-N
Molecular Weight 198.265 g/mol
SMILES C(#CC1CC(=O)CCC1)c1ccccc1
SPLASH splash10-0002-0900000000-844ccc500808712cb023
Source of Spectrum KC-1993-1661-36
Synonyms 3-(2-phenylethynyl)-1-cyclohexanone 3-(2-phenylethynyl)cyclohexan-1-one 3-(Phenylethynyl)cyclohexanone
Wiley ID 778261