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4'-(Phenylethynyl)acetophenone
SpectraBase Compound ID 9KtBOk8zshd
InChI InChI=1S/C16H12O/c1-13(17)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12H,1H3
InChIKey QCYZMMVPXNWSJK-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 Iq87ai2dz2w
Name 1-(4-(Phenylethynyl)phenyl)ethan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O
InChI InChI=1S/C16H12O/c1-13(17)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12H,1H3
InChIKey QCYZMMVPXNWSJK-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5RA00505A
Molecular Weight 220.271 g/mol
SMILES C(C)(=O)c1ccc(cc1)C#Cc1ccccc1
SPLASH splash10-0ab9-0290000000-fe45899f8e3246dd8848
Source of Spectrum RSA-5-18968-3h
Wiley ID 1802798