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(3E)-2,6,6-Trimethyl-1,3-undecadien-9-yn-5-one
SpectraBase Compound ID JLAdCkNrykE
InChI InChI=1S/C14H20O/c1-6-7-8-11-14(4,5)13(15)10-9-12(2)3/h9-10H,2,8,11H2,1,3-5H3/b10-9+
InChIKey JGHVJTBCTUPSFF-MDZDMXLPSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuJUA310Zdh
Name (3E)-2,6,6-Trimethyl-1,3-undecadien-9-yn-5-one
CAS Registry Number 91186-49-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-6-7-8-11-14(4,5)13(15)10-9-12(2)3/h9-10H,2,8,11H2,1,3-5H3/b10-9+
InChIKey JGHVJTBCTUPSFF-MDZDMXLPSA-N
Molecular Weight 204.313 g/mol
SMILES C(=O)(C(CCC#CC)(C)C)\C=C\C(=C)C
SPLASH splash10-00kn-9200000000-d9f766cea814d6ab712a
Synonyms (3E)-2,6,6-trimethyl-5-undeca-1,3-dien-9-ynone (3E)-2,6,6-trimethylundeca-1,3-dien-9-yn-5-one
Wiley ID 1483642