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2-Methyl-3-(phenylethynyl)cyclopent-2-en-1-one

View entire compound with spectra: 1 MS (GC)

2-Methyl-3-(phenylethynyl)cyclopent-2-en-1-one
SpectraBase Compound ID IwmpLOdXMtP
InChI InChI=1S/C14H12O/c1-11-13(9-10-14(11)15)8-7-12-5-3-2-4-6-12/h2-6H,9-10H2,1H3
InChIKey VJGHVBULVKUDSO-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C14H12O
Exact Mass 196.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2j5WzvuTXBz
Name 2-Methyl-3-(phenylethynyl)cyclopent-2-en-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O
InChI InChI=1S/C14H12O/c1-11-13(9-10-14(11)15)8-7-12-5-3-2-4-6-12/h2-6H,9-10H2,1H3
InChIKey VJGHVBULVKUDSO-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2016.07.058
Molecular Weight 196.249 g/mol
SMILES C1CC(C(=C1C#Cc1ccccc1)C)=O
SPLASH splash10-00kb-1900000000-f5af9967a6b1db885d62
Source of Spectrum Matthew A. Gubbels, et al. Tetrahedron, 10.1016/j.tet.2016.07.058
Wiley ID 1815061