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1,4-Diphenylbut-3-yne-1,2-dione

View entire compound with spectra: 3 MS (GC)

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 Gf1Pj9pTntS
Name 1,4-Diphenylbut-3-yne-1,2-dione
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
Literature Reference DOI 10.1002/anie.201103296
Molecular Weight 234.254 g/mol
SMILES c1cc(ccc1)C(=O)C(=O)C#Cc1ccccc1
SPLASH splash10-056r-3900000000-4596bf22d18d8694f50e
Source of Spectrum ACI-50-SM8-3a
Wiley ID 1780001