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(E)-7-(4-Acetylphenyl)-1-phenylhept-2-en-6-yn-1-one
SpectraBase Compound ID 79ePLKVOeOz
InChI InChI=1S/C21H18O2/c1-17(22)19-15-13-18(14-16-19)9-5-2-3-8-12-21(23)20-10-6-4-7-11-20/h4,6-8,10-16H,2-3H2,1H3/b12-8+
InChIKey HZKXHMYFWARUBJ-XYOKQWHBSA-N
Mol Weight 302.37 g/mol
Molecular Formula C21H18O2
Exact Mass 302.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vGTrsDoZ79
Name (E)-7-(4-Acetylphenyl)-1-phenylhept-2-en-6-yn-1-one
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.130679818 u
Formula C21H18O2
InChI InChI=1S/C21H18O2/c1-17(22)19-15-13-18(14-16-19)9-5-2-3-8-12-21(23)20-10-6-4-7-11-20/h4,6-8,10-16H,2-3H2,1H3/b12-8+
InChIKey HZKXHMYFWARUBJ-XYOKQWHBSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202203068
Quality 66
Reported Formula C21H18O2
SMILES C(#CC=1C=CC(=CC1)C(=O)C)CC\C=C\C(=O)C1=CC=CC=C1
SPLASH splash10-0a4i-0924000000-2d2adb68051b77b4c0be
Source of Spectrum QE-29-SM19-12b (DOI: 10.1002/chem.202203068)
Wiley ID 1909432