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(3E)-1-Cyclopropyl-5-methylhexa-3,5-dien-1-one
SpectraBase Compound ID 2W44fGzZtx0
InChI InChI=1S/C10H14O/c1-8(2)4-3-5-10(11)9-6-7-9/h3-4,9H,1,5-7H2,2H3/b4-3+
InChIKey XHMZKPSSDONYFF-ONEGZZNKSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZVW9Aruz7U
Name (3E)-1-Cyclopropyl-5-methylhexa-3,5-dien-1-one
Comments Note: The molecular formula of the structure shown is C10H14O - which differs from the formula reported for the mass spectrum (C13H20O)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C10H14O/c1-8(2)4-3-5-10(11)9-6-7-9/h3-4,9H,1,5-7H2,2H3/b4-3+
InChIKey XHMZKPSSDONYFF-ONEGZZNKSA-N
Molecular Weight 150.221 g/mol
SMILES C1(CC1)C(C\C=C\C(=C)C)=O
SPLASH splash10-0006-1900000000-198bb3f00d0445e6f416
Source of Spectrum SO-0-665-3
Synonyms (E)-2-Methyl-undeca-1,3-dien-6-one
Wiley ID 874481