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1,4-Diphenylbut-3-yne-1,2-dione
SpectraBase Compound ID 8qP9mZWE2o0
InChI InChI=1S/C16H10O2/c17-15(12-11-13-7-3-1-4-8-13)16(18)14-9-5-2-6-10-14/h1-10H
InChIKey OXYFBILTYRSFTD-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C16H10O2
Exact Mass 234.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ErjQfp4HJMh
Name 1,4-diphenylbut-3-yn-1,2-dione
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10O2
InChI InChI=1S/C16H10O2/c17-15(12-11-13-7-3-1-4-8-13)16(18)14-9-5-2-6-10-14/h1-10H
InChIKey OXYFBILTYRSFTD-UHFFFAOYSA-N
Instrument Name GC2010/Shimadzu GCMS QP2010S
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.136
Molecular Weight 234.254 g/mol
SMILES c1cc(ccc1)C(=O)C(C#Cc1ccccc1)=O
SPLASH splash10-004i-9600000000-dc32e846407dee06cd2f
Source of Spectrum BJO-15-SM4-3a
Wiley ID 1840917