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2-Methylnona-2,7-dien-5-yn-4-one
SpectraBase Compound ID JTwTQ36MG9X
InChI InChI=1S/C10H12O/c1-4-5-6-7-10(11)8-9(2)3/h4-5,8H,1-3H3
InChIKey NGGQKURWYQLEMR-UHFFFAOYSA-N
Mol Weight 148.2 g/mol
Molecular Formula C10H12O
Exact Mass 148.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2d4hpuN81u9
Name 2-Methylnona-2,7-dien-5-yn-4-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O
InChI InChI=1S/C10H12O/c1-4-5-6-7-10(11)8-9(2)3/h4-5,8H,1-3H3
InChIKey NGGQKURWYQLEMR-UHFFFAOYSA-N
Instrument Name Agilent HP 6890 or Waters Autospec Premier sprctrometer magnetic sector
Ionization Type EI
Literature Reference DOI 10.1002/anie.201908496
Molecular Weight 148.205 g/mol
Reported Formula C10H14O
SMILES CC(C)=CC(C#CC=CC)=O
SPLASH splash10-053r-7900000000-e4dd8a43eb2cbcc5bff4
Source of Spectrum ACI-58-SM32-SI-3
Thin-Layer Chromatography Rf = 0.39 (petroleum ether/Et2O, 80:20)
Wiley ID 1875571