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5,5-Dimethyl-1-phenyl-3-hexyn-2-one
SpectraBase Compound ID 8WBDreHKlCl
InChI InChI=1S/C14H16O/c1-14(2,3)10-9-13(15)11-12-7-5-4-6-8-12/h4-8H,11H2,1-3H3
InChIKey YIBQVPXQVWGLAF-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Garc2wc1K28
Name 5,5-Dimethyl-1-phenyl-3-hexyn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c1-14(2,3)10-9-13(15)11-12-7-5-4-6-8-12/h4-8H,11H2,1-3H3
InChIKey YIBQVPXQVWGLAF-UHFFFAOYSA-N
Molecular Weight 200.281 g/mol
SMILES c1ccc(cc1)CC(C#CC(C)(C)C)=O
SPLASH splash10-004i-9200000000-411f578cd1eed61610ab
Synonyms 5,5-Dimethyl-1-phenyl-hex-3-yn-2-one
Wiley ID 1470148