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1-(3,4-diethynyl-3-cyclohexen-1-yl)ethanone
SpectraBase Compound ID IJZMkaR5bIk
InChI InChI=1S/C12H12O/c1-4-10-6-7-12(9(3)13)8-11(10)5-2/h1-2,12H,6-8H2,3H3
InChIKey XZSZWKNBVVPCEP-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HyLTpsp5puD
Name 1-(3,4-diethynyl-3-cyclohexen-1-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O
InChI InChI=1S/C12H12O/c1-4-10-6-7-12(9(3)13)8-11(10)5-2/h1-2,12H,6-8H2,3H3
InChIKey XZSZWKNBVVPCEP-UHFFFAOYSA-N
Molecular Weight 172.227 g/mol
SMILES C1(=C(C#C)CCC(C1)C(=O)C)C#C
SPLASH splash10-0l6r-1900000000-23b09a5cbba355294ead
Source of Spectrum U-1996-1309-43
Synonyms 4-Acetyl-1,2-bis[(ethynyl]-1-cyclohexene
Wiley ID 768620