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1,4-Diphenylbut-3-yn-2-one
SpectraBase Compound ID C4TNIkY5mnX
InChI InChI=1S/C16H12O/c17-16(13-15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10H,13H2
InChIKey IWCMRVFONGZPMZ-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 Ba2DaBADu6X
Name 1,4-Diphenylbut-3-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O
InChI InChI=1S/C16H12O/c17-16(13-15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10H,13H2
InChIKey IWCMRVFONGZPMZ-UHFFFAOYSA-N
Molecular Weight 220.271 g/mol
SMILES C(#Cc1ccccc1)C(=O)Cc1ccccc1
SPLASH splash10-004i-1910000000-f3e12c137c05ee1c3a9e
Source of Spectrum F-67-7390-1c
Wiley ID 1687691