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(1E)-1-(4-Chlorophenyl)-6-phenylhex-1-en-5-yne-3,4-dione
SpectraBase Compound ID HQAmm6jVrkB
InChI InChI=1S/C18H11ClO2/c19-16-10-6-15(7-11-16)9-13-18(21)17(20)12-8-14-4-2-1-3-5-14/h1-7,9-11,13H/b13-9+
InChIKey ZXWOWZDCTXBZTK-UKTHLTGXSA-N
Mol Weight 294.74 g/mol
Molecular Formula C18H11ClO2
Exact Mass 294.044757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jdqm1HO4SxX
Name (1E)-1-(4-Chlorophenyl)-6-phenylhex-1-en-5-yne-3,4-dione
Alternate Name(s) (E)-1-(4-chlorophenyl)-6-phenylhex-1-en-5-yne-3,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11ClO2
InChI InChI=1S/C18H11ClO2/c19-16-10-6-15(7-11-16)9-13-18(21)17(20)12-8-14-4-2-1-3-5-14/h1-7,9-11,13H/b13-9+
InChIKey ZXWOWZDCTXBZTK-UKTHLTGXSA-N
Literature Reference DOI 10.1002/anie.201103296
Molecular Weight 294.737 g/mol
SMILES C(\C=C\c1ccc(cc1)Cl)(=O)C(C#Cc1ccccc1)=O
SPLASH splash10-014i-2900000000-a51b0af3a2aa9cbc5ba5
Source of Spectrum ACI-50-SM14-3g
Wiley ID 1780006