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4-(4-Methylphenyl)but-3-yn-2-one
SpectraBase Compound ID BnHGoml4Unc
InChI InChI=1S/C11H10O/c1-9-3-6-11(7-4-9)8-5-10(2)12/h3-4,6-7H,1-2H3
InChIKey IBBJVOOWGINANG-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C11H10O
Exact Mass 158.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIlgZwq7tcn
Name 4-(4-Methylphenyl)but-3-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O
InChI InChI=1S/C11H10O/c1-9-3-6-11(7-4-9)8-5-10(2)12/h3-4,6-7H,1-2H3
InChIKey IBBJVOOWGINANG-UHFFFAOYSA-N
Molecular Weight 158.200 g/mol
SMILES CC(C#Cc1ccc(cc1)C)=O
SPLASH splash10-0006-0900000000-89a87e77b41234bce9b4
Source of Spectrum K-2001-739-3
Synonyms 4-(4-Methylphenyl)-3-butyn-2-one 4-(p-Tolyl)but-3-yn-2-one
Wiley ID 1578759