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4-(2,2-Dimethyl-6-ethylcyclohex-1-yl)-3-butyn-2-yl acetate
SpectraBase Compound ID 6SUnAhjqP4a
InChI InChI=1S/C16H24O2/c1-6-14-8-7-11-16(4,5)15(14)10-9-12(2)18-13(3)17/h12H,6-8,11H2,1-5H3
InChIKey RQTSSGZASBIJLU-UHFFFAOYSA-N
Mol Weight 248.37 g/mol
Molecular Formula C16H24O2
Exact Mass 248.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LgnSxn0mBdl
Name 4-(2,2-Dimethyl-6-ethylcyclohex-1-yl)-3-butyn-2-yl acetate
Alternate Name(s) 3-(2-Ethyl-6,6-dimethyl-1-cyclohexen-1-yl)-1-methyl-2-propynyl acetate 4-(2-Ethyl-6,6-dimethyl-cyclohex-1-enyl)-3-butyn-2-yl acetate
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Formula C16H24O2
InChI InChI=1S/C16H24O2/c1-6-14-8-7-11-16(4,5)15(14)10-9-12(2)18-13(3)17/h12H,6-8,11H2,1-5H3
InChIKey RQTSSGZASBIJLU-UHFFFAOYSA-N
Molecular Weight 248.366 g/mol
SMILES C(C1=C(CCCC1(C)C)CC)#CC(OC(=O)C)C
SPLASH splash10-00ea-0900000000-b01a8d6fe61e2e73252f
Source of Spectrum QA-37-595-11
Wiley ID 861169