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5-Methyl-5,9,9-triphenylnon-8-en-6-yn-2-one
SpectraBase Compound ID 1tJLml2gWKz
InChI InChI=1S/C28H26O/c1-23(29)20-22-28(2,26-17-10-5-11-18-26)21-12-19-27(24-13-6-3-7-14-24)25-15-8-4-9-16-25/h3-11,13-19H,20,22H2,1-2H3
InChIKey FYNDVEXXODOFMW-UHFFFAOYSA-N
Mol Weight 378.52 g/mol
Molecular Formula C28H26O
Exact Mass 378.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILjEmvaQlD2
Name 5-Methyl-5,9,9-triphenylnon-8-en-6-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26O
InChI InChI=1S/C28H26O/c1-23(29)20-22-28(2,26-17-10-5-11-18-26)21-12-19-27(24-13-6-3-7-14-24)25-15-8-4-9-16-25/h3-11,13-19H,20,22H2,1-2H3
InChIKey FYNDVEXXODOFMW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol800463k
Molecular Weight 378.515 g/mol
SMILES C(C(CCC(C)=O)(c1ccccc1)C)#CC=C(c1ccccc1)c1ccccc1
SPLASH splash10-054o-1193000000-aa6d8c36a1772b492d8f
Source of Spectrum A1-10-1943/SMS53-8g
Wiley ID 1759369