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2,5-Cyclohexadien-1-one, 4-methyl-2-(2-methyl-2-propenyl)-4-(2-propynyl)-
SpectraBase Compound ID 5N6h1pUWoVo
InChI InChI=1S/C14H16O/c1-5-7-14(4)8-6-13(15)12(10-14)9-11(2)3/h1,6,8,10H,2,7,9H2,3-4H3
InChIKey VDFAVEYQQSAMFQ-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9lT5NkYovy
Name 2,5-Cyclohexadien-1-one, 4-methyl-2-(2-methyl-2-propenyl)-4-(2-propynyl)-
CAS Registry Number 93518-41-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c1-5-7-14(4)8-6-13(15)12(10-14)9-11(2)3/h1,6,8,10H,2,7,9H2,3-4H3
InChIKey VDFAVEYQQSAMFQ-UHFFFAOYSA-N
Molecular Weight 200.281 g/mol
SMILES C1(=CC(CC#C)(C)C=CC1=O)CC(=C)C
SPLASH splash10-03di-1900000000-fa548b989e885b1225c2
Source of Spectrum H-67-1306-0
Synonyms 4-Methyl-2-(2'-methylallyl)-4-(2''-propinyl)cyclohexa-2,5-dien-1-one 4-Methyl-2-(2'-methylallyl)-4-(2''-propinyl)cyclohexa-2,5-dien-1-one 4-Methyl-2-(2-methyl-2-propenyl)-4-(2-propynyl)-2,5-cyclohexadien-1-one
Wiley ID 1198297