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1,5-Diphenyl-4-pentyn-1-one
SpectraBase Compound ID 7D9vYrEvsjs
InChI InChI=1S/C17H14O/c18-17(16-12-5-2-6-13-16)14-8-7-11-15-9-3-1-4-10-15/h1-6,9-10,12-13H,8,14H2
InChIKey JRGWTGSUFVGGLR-UHFFFAOYSA-N
Mol Weight 234.3 g/mol
Molecular Formula C17H14O
Exact Mass 234.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NILK4CLv3u
Name 1,5-Diphenyl-4-pentyn-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O
InChI InChI=1S/C17H14O/c18-17(16-12-5-2-6-13-16)14-8-7-11-15-9-3-1-4-10-15/h1-6,9-10,12-13H,8,14H2
InChIKey JRGWTGSUFVGGLR-UHFFFAOYSA-N
Molecular Weight 234.298 g/mol
SMILES C(CCC#Cc1ccccc1)(=O)c1ccccc1
SPLASH splash10-0a59-0950000000-a30c807a7da30744d99a
Source of Spectrum H1-42-390-16
Wiley ID 757555