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3-(4-methylphenyl)-1-phenylprop-2-yn-1-one
SpectraBase Compound ID ILIKU1KourG
InChI InChI=1S/C16H12O/c1-13-7-9-14(10-8-13)11-12-16(17)15-5-3-2-4-6-15/h2-10H,1H3
InChIKey ODMJODNPAIICIH-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C16H12O
Exact Mass 220.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bpVTb2UI4G
Name 3-(4-methylphenyl)-1-phenylprop-2-yn-1-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.088815005 u
Formula C16H12O
InChI InChI=1S/C16H12O/c1-13-7-9-14(10-8-13)11-12-16(17)15-5-3-2-4-6-15/h2-10H,1H3
InChIKey ODMJODNPAIICIH-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504255
Molecular Weight 220.271 g/mol
Quality 265
SMILES CC1=CC=C(C=C1)C#CC(=O)C1=CC=CC=C1
SPLASH splash10-0006-0930000000-e701d6e87ad3ac8aad4a
Source of Spectrum QE-21-SM8-17 (DOI: 10.1002/chem.201504255)
Wiley ID 1907506