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1-(4-Methylphenyl)-3-phenylprop-2-yn-1-one
SpectraBase Compound ID LcHPWBDd8K4
InChI InChI=1S/C16H12O/c1-13-7-10-15(11-8-13)16(17)12-9-14-5-3-2-4-6-14/h2-8,10-11H,1H3
InChIKey HZTQMHOPSAEKFO-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 IIgKljCSXMV
Name 1-(4-methylphenyl)-3-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/c1-13-7-10-15(11-8-13)16(17)12-9-14-5-3-2-4-6-14/h2-8,10-11H,1H3
InChIKey HZTQMHOPSAEKFO-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201504255
Molecular Weight 220.271 g/mol
Quality 253
SMILES CC1=CC=C(C=C1)C(C#CC1=CC=CC=C1)=O
SPLASH splash10-006x-0930000000-7268b115a0c25ce4e621
Source of Spectrum QE-21-SM3-3 (DOI: 10.1002/chem.201504255)
Wiley ID 1907512