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1-(4-Methyl-3-cyclohexenyl)-3-butyn-2-one
SpectraBase Compound ID FXPtgPdcs9J
InChI InChI=1S/C11H14O/c1-3-11(12)8-10-6-4-9(2)5-7-10/h1,4,10H,5-8H2,2H3
InChIKey WMLMLPYTQDTHCC-UHFFFAOYSA-N
Mol Weight 162.23 g/mol
Molecular Formula C11H14O
Exact Mass 162.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2NQEGPdyAa9
Name 1-(4-Methyl-3-cyclohexenyl)-3-butyn-2-one
Alternate Name(s) 1-(4-Methylcyclohex-3-en-1-yl)but-3-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O
InChI InChI=1S/C11H14O/c1-3-11(12)8-10-6-4-9(2)5-7-10/h1,4,10H,5-8H2,2H3
InChIKey WMLMLPYTQDTHCC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19850680208
Molecular Weight 162.232 g/mol
SMILES C(C(C#C)=O)C1CC=C(CC1)C
SPLASH splash10-002f-9000000000-f9c355a2528fa784f5a0
Source of Spectrum H-68-342-2
Wiley ID 1794880